| CAS Number | 19991-88-9 |
| Catalog Number | AG00C2K1(AGN-PC-0WBN45) |
| Chemical Name | (E)-6-Amino-2-hexenoic Acid Hydrochloride |
| IUPAC Name | (E)-6-aminohex-2-enoic acid;hydrochloride |
| InChI | InChI=1S/C6H11NO2.ClH/c7-5-3-1-2-4-6(8)9;/h2,4H,1,3,5,7H2,(H,8,9);1H/b4-2+; |
| InChI Key | OULZEYQKBDXFKX-VEELZWTKSA-N |
| MDL Number | MFCD28143398 |
| Molecular Formula | C6H12ClNO2 |
| Molecular Weight | 165.6180 |
| SMILES | C(C/C=C/C(=O)O)CN.Cl |
| Synonyms | (E)-6-Amino-2-hexenoic Acid Hydrochloride,
19991-88-9,
(E)-6-Aminohex-2-enoic Acid Hydrochloride,
SCHEMBL2821126,
DTXSID90648511,
(2E)-6-Amino-2-hexenoic Acid Hydrochloride,
(2E)-6-Aminohex-2-enoic acid--hydrogen chloride (1/1),
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Exact Mass | 165.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.617g/mol |
| Monoisotopic Mass | 165.056g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number