| CAS Number | 879500-49-9 |
| Catalog Number | AG00IEU5(AGN-PC-0VHTVK) |
| Chemical Name | Amino(2-methylphenyl)acetic acid hydrochloride |
| IUPAC Name | 2-amino-2-(2-methylphenyl)acetic acid;hydrochloride |
| InChI | InChI=1S/C9H11NO2.ClH/c1-6-4-2-3-5-7(6)8(10)9(11)12;/h2-5,8H,10H2,1H3,(H,11,12);1H |
| InChI Key | SNJXKWGGOWIUKE-UHFFFAOYSA-N |
| MDL Number | MFCD06410551 |
| Molecular Formula | C9H12ClNO2 |
| Molecular Weight | 201.6501 |
| SMILES | O=C(O)C(N)C1=CC=CC=C1C.[H]Cl |
| Synonyms | 879500-49-9,
Amino(2-methylphenyl)acetic acid hydrochloride,
2-Amino-2-(O-tolyl)acetic acid hydrochloride,
(R)-2-Amino-2-(o-tolyl)acetic acid hydrochloride,
1192350-45-0,
SCHEMBL3820573,
AB24607,
2-AMINO-2-O-TOLYLACETIC ACID HYDROCHLORIDE,
Benzeneacetic acid, a-amino-2-methyl-, hydrochloride,
amino-o-tolyl-acetic acid hydrochloride,
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| Complexity | 170 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.65g/mol |
| Monoisotopic Mass | 201.056g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 63.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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