Home Halogens Benzenepropanoic acid, 4-chloro-b-hydroxy-

Benzenepropanoic acid, 4-chloro-b-hydroxy-

CAS No.:
25209-46-5
Catalog Number:
AG019U3N
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
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Product Description
Catalog Number:
AG019U3N
Chemical Name:
Benzenepropanoic acid, 4-chloro-b-hydroxy-
CAS Number:
25209-46-5
Molecular Formula:
C9H9ClO3
Molecular Weight:
200.6190
MDL Number:
MFCD16304917
IUPAC Name:
3-(4-chlorophenyl)-3-hydroxypropanoic acid
InChI:
InChI=1S/C9H9ClO3/c10-7-3-1-6(2-4-7)8(11)5-9(12)13/h1-4,8,11H,5H2,(H,12,13)
InChI Key:
NRRQHJBZRHOVAO-UHFFFAOYSA-N
SMILES:
OC(c1ccc(cc1)Cl)CC(=O)O
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.024g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
200.618g/mol
Monoisotopic Mass:
200.024g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties