Home Halogens 3-chloro-4-(cyclopropylmethoxy)Benzoic acid

3-chloro-4-(cyclopropylmethoxy)Benzoic acid

CAS No.:
856165-89-4
Catalog Number:
AG00G97U
Molecular Formula:
C11H11ClO3
Molecular Weight:
226.6562
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Product Description
Catalog Number:
AG00G97U
Chemical Name:
3-chloro-4-(cyclopropylmethoxy)Benzoic acid
CAS Number:
856165-89-4
Molecular Formula:
C11H11ClO3
Molecular Weight:
226.6562
MDL Number:
MFCD14652993
IUPAC Name:
3-chloro-4-(cyclopropylmethoxy)benzoic acid
InChI:
InChI=1S/C11H11ClO3/c12-9-5-8(11(13)14)3-4-10(9)15-6-7-1-2-7/h3-5,7H,1-2,6H2,(H,13,14)
InChI Key:
BLMUANMNUNBEJS-UHFFFAOYSA-N
SMILES:
Clc1cc(ccc1OCC1CC1)C(=O)O
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.04g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.656g/mol
Monoisotopic Mass:
226.04g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties