| CAS Number | 1152927-77-9 |
| Catalog Number | AG018RWN(AGN-PC-0WNNNK) |
| Chemical Name | 2-amino-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol |
| IUPAC Name | 2-amino-1-(1-methylpyrazol-4-yl)ethanol |
| InChI | InChI=1S/C6H11N3O/c1-9-4-5(3-8-9)6(10)2-7/h3-4,6,10H,2,7H2,1H3 |
| InChI Key | QKHNQZUVFSQKFD-UHFFFAOYSA-N |
| MDL Number | MFCD11108415 |
| Molecular Formula | C6H11N3O |
| Molecular Weight | 141.1710 |
| SMILES | CN1N=CC(C(CN)O)=C1 |
| Synonyms | 2-amino-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol,
1152927-77-9,
(1R)-2-Amino-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol,
1567954-38-4,
1567962-29-1,
(1S)-2-amino-1-(1-methyl-1H-pyrazol-4-yl)ethan-1-ol,
SCHEMBL17327337,
AKOS009209945,
MCULE-3817884356,
NE56781,
EN300-86044,
2-amino-1-(1-methyl-1H-pyrazol-4-yl)ethanol,
F8881-2740,
Z1575308473,
2-Amino-1-(1-methyl-1H-pyrazol-4-yl)-ethanol,
|
| Complexity | 109 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.174g/mol |
| Monoisotopic Mass | 141.09g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 64.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number