| CAS Number | 15344-34-0 |
| Catalog Number | AG00AC7W(AGN-PC-0NDLR9) |
| Chemical Name | 2-Hydroxy-3-methylbutanenitrile |
| IUPAC Name | 2-hydroxy-3-methylbutanenitrile |
| InChI | InChI=1S/C5H9NO/c1-4(2)5(7)3-6/h4-5,7H,1-2H3 |
| InChI Key | YRBPUNHOIVAUFA-UHFFFAOYSA-N |
| MDL Number | MFCD00798446 |
| Molecular Formula | C5H9NO |
| Molecular Weight | 99.1311 |
| SMILES | CC(C(C#N)O)C |
| Synonyms | 2-hydroxy-3-methylbutanenitrile,
15344-34-0,
ISOBUTYRALDEHYDE CYANOHYDRIN,
Isobutanal cyanhydrin,
AC1Q1O88,
ALBB-022333,
4772AD,
MFCD00798446,
AKOS008146495,
AB07208,
MCULE-1764798154,
BUTANENITRILE, 2-HYDROXY-3-METHYL-,
R3824,
EN300-62480,
C5H9NO,
2-hydroxy-3-methyl-butanenitrile,
CID11126188,
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| Complexity | 89.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 99.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 99.133g/mol |
| Monoisotopic Mass | 99.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 44A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number