General Information of DIG (ID: E06CNF)
DIG Name
Isobutyl alcohol
Synonyms    Click to Show/Hide the Synonyms of This DIG
2-Methyl-1-propanol; Isobutanol; ISOBUTYL ALCOHOL; 2-Methylpropan-1-ol; 78-83-1; 1-Propanol, 2-methyl-; 1-Hydroxymethylpropane; Isopropylcarbinol; i-Butyl alcohol; Iso-butyl alcohol; 2-Methylpropyl alcohol; Isobutylalkohol; 2-Methylpropanol; Alcool isobutylique; 2-Methyl propanol; i-Butanol; Fermentation butyl alcohol; iso-butanol; RCRA waste number U140; 2-Methylpropanol-1; Isopropyl carbitol; NSC 5708; UNII-56F9Z98TEM; Methyl-2 propanol-1; iso-C4H9OH; MFCD00004740; 2-methyl-1-propanyl alcohol; 56F9Z98TEM; CHEBI:46645; Isobutylalkohol [Czech]; FEMA Number 2179; Alcohols, C8-13-iso-; Isobutyl alcohol (natural); 2-METHYLPROPYL-2-D1 ALCOHOL; Alcool isobutylique [French]; HSDB 49; 2-Methyl-1-propanol, 99+%, extra pure; 2-Methyl-1-propanol, 99+%, ACS reagent; FEMA No. 2179; CCRIS 2300; 72182-69-5; EINECS 201-148-0; UN1212; 2-Methyl-1-propanol, 99+%, Extra Dry, AcroSeal(R); 2-Methyl-1-propanol, 99+%, spectrophotometric grade; RCRA waste no. U140; BRN 1730878; isobutylalcohol; iso butanol; Butanol-iso; AI3-01777; 2-methylpropanoI; iBuOH; Isobutyl alcohol; ; 2-methyl-propanol; iso-BuOH; EINECS 273-552-5; i-BuOH; 2-methyl-l-propanol; 2-methyl-n-propanol; Isobutanol ACS grade; Propanol, 2-methyl-; 2-methyl-propan-1-ol; ACMC-209pff; Isobutanol, HPLC Grade; DSSTox_CID_1759; EC 201-148-0; DSSTox_RID_76310; DSSTox_GSID_21759; Isobutyl Alcohol Reagent ACS; 4-01-00-01588 (Beilstein Handbook Reference); 68989-27-5; BIDD:ER0628; Isobutanol or isobutyl alcohol; 2-Methyl-1-propanol, 99%; NATURAL ISOBUTYL ALCOHOL; CHEMBL269630; DTXSID0021759; WLN: Q1Y1&1; 2-Methyl-1-propanol, for HPLC; NSC5708; 2-Methyl-1-propanol, 99.5%; Isobutyl Alcohol (Fragrance Grade); 2-Methyl-1-propanol, AR, 99%; 2-METHYL-D3-PROPYL ALCOHOL; ACT03408; Isobutanol, Spectrophotometric Grade; NSC-5708; ZINC1687155; Tox21_201214; 1-$l^{1}-oxidanyl-2-methylpropane; ANW-37225; LMFA05000100; STL185664; 2-Methyl-1-propanol, LR, >=99%; AKOS000118740; Isobutyl alcohol, >=99%, FCC, FG; MCULE-6294327194; UN 1212; CAS-78-83-1; NCGC00091851-01; NCGC00091851-02; NCGC00258766-01; 2-Methyl-1-propanol, analytical standard; 2-Methyl-1-propanol, anhydrous, 99.5%; 2-Methyl-1-propanol, for HPLC, 99.5%; Isobutyl alcohol, ACS reagent, >=99.0%; 821-EP2269986A1; 821-EP2274983A1; 821-EP2284157A1; 821-EP2287152A2; 821-EP2305825A1; 821-EP2308857A1; 821-EP2380568A1; FT-0627343; I0094; Z1849; Isobutanol, >50% in a non hazardous diluent; Isobutyl alcohol 5000 microg/mL in Methanol; 2-Methyl-1-propanol 10 microg/mL in Methanol; C14710; Isobutyl alcohol, natural, >=99%, FCC, FG; 2-Methyl-1-propanol, ACS reagent, >=99.0%; 28287-EP2270012A1; 28287-EP2270013A1; 28287-EP2272849A1; 28287-EP2275423A1; 28287-EP2280005A1; 28287-EP2289509A2; 28287-EP2289884A1; 28287-EP2289892A1; 28287-EP2292576A2; 28287-EP2292613A1; 28287-EP2295424A1; 28287-EP2298313A1; 28287-EP2298751A2; 28287-EP2301919A1; 28287-EP2305033A1; 28287-EP2305254A1; 28287-EP2305625A1; 28287-EP2305647A1; 28287-EP2305681A1; 28287-EP2305825A1; 28287-EP2308849A1; 28287-EP2308850A1; 28287-EP2308864A1; 28287-EP2311801A1; 28287-EP2311802A1; 28287-EP2311803A1; 28287-EP2311821A1; 28287-EP2311838A1; 28287-EP2314577A1; 28287-EP2371814A1; 28287-EP2374780A1; 28287-EP2374781A1; 28287-EP2377844A2; 45218-EP2292616A1; 45218-EP2311821A1; 74956-EP2275411A2; 74956-EP2275414A1; 74956-EP2281821A1; 74956-EP2298763A1; 74956-EP2305254A1; 74956-EP2305667A2; 74956-EP2308838A1; 74956-EP2374780A1; 74956-EP2374781A1; Q151797; 1-Propan-3,3,3-d3-ol,2-(methyl-d3)- (9CI); 2-Methyl-1-propanol, p.a., ACS reagent, 99.0%; 2-Methyl-1-propanol, SAJ first grade, >=99.0%; Isobutanol, >10 - 50% in a non hazardous diluent; J-509912; 2-Methyl-1-propanol, JIS special grade, >=99.0%; F0001-2058; Z955123524; UNII-WB09NY83YA component ZXEKIIBDNHEJCQ-UHFFFAOYSA-N; 2-Methyl-1-propanol, ACS spectrophotometric grade, >=99.0%; 2-Methyl-1-propanol, reag. ISO, 99%, UV HPLC spectroscopic; Isobutanol or isobutyl alcohol [UN1212] [Flammable liquid]; 2-Methyl-1-propanol, puriss. p.a., ACS reagent, >=99.5% (GC); 2-Methyl-1-propanol, BioUltra, for molecular biology, >=99.5% (GC); 2-Methyl-1-propanol, United States Pharmacopeia (USP) Reference Standard; 2-Methyl-1-propanol, puriss. p.a., ACS reagent, reag. Ph. Eur., >=99% (GC); 20440-13-5; 5OZ; 95927-04-1
DIG Function
Flavoring agent; Solvent
PubChem CID
6560
Formula
C4H10O
Canonical SMILES
CC(C)CO
InChI
1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
InChIKey
ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=6560"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 74.12 Topological Polar Surface Area 20.2
XlogP 0.8 Complexity 17.6
Heavy Atom Count 5 Rotatable Bond Count 1
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 1
Full List of Active Pharmaceutical Ingredients (APIs) Co-administrated with This DIG
       ICD Disease Classification 02 Benign/in-situ/malignant neoplasm Click to Show/Hide
Temozolomide
API Info
Brain cancer [ICD-11: 2A00]
[1]
       ICD Disease Classification 08 Nervous system disease Click to Show/Hide
Valproic acid
API Info
Epilepsy [ICD-11: 8A60]
[2]
       ICD Disease Classification 11 Circulatory system disease Click to Show/Hide
Nifedipine
API Info
Angina pectoris [ICD-11: BA40]
[3]
       ICD Disease Classification 13 Digestive system disease Click to Show/Hide
Pantoprazole
API Info
Gastro-oesophageal reflux disease [ICD-11: DA22]
[4]
References
1 FDA label for approved temozolomide from the official website of the U.S. Food and Drug Administration.
2 FDA label for approved valproic acid from the official website of the U.S. Food and Drug Administration.
3 FDA label for approved nifedipine from the official website of the U.S. Food and Drug Administration.
4 FDA label for approved pantoprazole from the official website of the U.S. Food and Drug Administration.

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