Benzeneacetic acid, 4-chloro-a-(1-methylethyl)-


Chemical Name: Benzeneacetic acid, 4-chloro-a-(1-methylethyl)-
CAS Number: 2012-74-0
Product Number: AG00I3RG(AGN-PC-0QS030)
Synonyms:
MDL No:
Molecular Formula: C11H13ClO2
Molecular Weight: 212.6727

Identification/Properties


Computed Properties
Molecular Weight:
212.673g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
212.06g/mol
Monoisotopic Mass:
212.06g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
196
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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