Home Aminos 2-amino-3-[4-(methylsulfanyl)phenyl]propanoic acid hydrochloride

2-amino-3-[4-(methylsulfanyl)phenyl]propanoic acid hydrochloride

CAS No.:
1251924-17-0
Catalog Number:
AG01A7WN
Molecular Formula:
C10H14ClNO2S
Molecular Weight:
247.7417
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Product Description
Catalog Number:
AG01A7WN
Chemical Name:
2-amino-3-[4-(methylsulfanyl)phenyl]propanoic acid hydrochloride
CAS Number:
1251924-17-0
Molecular Formula:
C10H14ClNO2S
Molecular Weight:
247.7417
MDL Number:
MFCD14705859
IUPAC Name:
2-amino-3-(4-methylsulfanylphenyl)propanoic acid;hydrochloride
InChI:
InChI=1S/C10H13NO2S.ClH/c1-14-8-4-2-7(3-5-8)6-9(11)10(12)13;/h2-5,9H,6,11H2,1H3,(H,12,13);1H
InChI Key:
ZCGLTWKZDVWGGK-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1)CC(C(=O)O)N.Cl
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.043g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
247.737g/mol
Monoisotopic Mass:
247.043g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
88.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties