| CAS Number | 1624260-21-4 |
| Catalog Number | AG001T2Z(AGN-PC-0WANEU) |
| Chemical Name | 4-Pyridinepropanoic acid, α-amino-, hydrochloride (1:1) |
| IUPAC Name | 2-amino-3-pyridin-4-ylpropanoic acid;hydrochloride |
| InChI | InChI=1S/C8H10N2O2.ClH/c9-7(8(11)12)5-6-1-3-10-4-2-6;/h1-4,7H,5,9H2,(H,11,12);1H |
| InChI Key | DIUTWKZSBAFEEB-UHFFFAOYSA-N |
| MDL Number | MFCD28125538 |
| Molecular Formula | C8H11ClN2O2 |
| Molecular Weight | 202.6381 |
| SMILES | O=C(O)C(N)CC1=CC=NC=C1.Cl |
| Synonyms | 2-Amino-3-(pyridin-4-yl)propanoic acid hydrochloride,
1624260-21-4,
AK159175,
SCHEMBL5966996,
KS-00000SI3,
MFCD28125538,
AKOS024464035,
DS-9641,
CS-0035623,
ST24039902,
2-Amino-3-(pyridin-4-yl)propanoic acid HCl,
2-amino-3-pyridin-4-ylpropanoic acid;hydrochloride,
4-Pyridinepropanoic acid, alpha-amino-, hydrochloride (1:1),
(S)-2-Amino-3-(pyridin-4-yl)propanoic acid hydrochloride,
(R)-2-Amino-3-(pyridin-4-yl)propanoic acid hydrochloride,
369403-60-1,
N/A,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.638g/mol |
| Monoisotopic Mass | 202.051g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 76.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number