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1810074-86-2 | L-Phenylalanine, chloro-, methyl ester, hydrochloride (1:1)
CAS No: 1810074-86-2 Catalog No: AG0022LF MDL No:MFCD24435094
Product Description
Catalog Number:
AG0022LF
Chemical Name:
L-Phenylalanine, chloro-, methyl ester, hydrochloride (1:1)
CAS Number:
1810074-86-2
Molecular Formula:
C10H13Cl2NO2
Molecular Weight:
250.1217
MDL Number:
MFCD24435094
IUPAC Name:
methyl (2S)-2-amino-3-(5-chloropyridin-2-yl)propanoate;hydrochloride
InChI:
InChI=1S/C9H11ClN2O2.ClH/c1-14-9(13)8(11)4-7-3-2-6(10)5-12-7;/h2-3,5,8H,4,11H2,1H3;1H/t8-;/m0./s1
InChI Key:
QPKJLMVYNDVQNM-QRPNPIFTSA-N
SMILES:
ClN[C@H](C(=O)OC)Cc1ccccc1.Cl
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
250.028g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
251.107g/mol
Monoisotopic Mass:
250.028g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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