Home Halogens Benzoic acid, 2-chloro-4-(1-methylethoxy)-

Benzoic acid, 2-chloro-4-(1-methylethoxy)-

CAS No.:
334018-32-5
Catalog Number:
AG00I6KS
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
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Product Description
Catalog Number:
AG00I6KS
Chemical Name:
Benzoic acid, 2-chloro-4-(1-methylethoxy)-
CAS Number:
334018-32-5
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
MDL Number:
MFCD17256599
IUPAC Name:
2-chloro-4-propan-2-yloxybenzoic acid
InChI:
InChI=1S/C10H11ClO3/c1-6(2)14-7-3-4-8(10(12)13)9(11)5-7/h3-6H,1-2H3,(H,12,13)
InChI Key:
ACGZKCQTHXAZOX-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(c(c1)Cl)C(=O)O)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.645g/mol
Monoisotopic Mass:
214.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties