Home Halogens 2-chloro-3-formylbenzoic acid

2-chloro-3-formylbenzoic acid

CAS No.:
1289106-07-5
Catalog Number:
AG01B1S0
Molecular Formula:
C8H5ClO3
Molecular Weight:
184.5765
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Product Description
Catalog Number:
AG01B1S0
Chemical Name:
2-chloro-3-formylbenzoic acid
CAS Number:
1289106-07-5
Molecular Formula:
C8H5ClO3
Molecular Weight:
184.5765
MDL Number:
MFCD26855791
IUPAC Name:
2-chloro-3-formylbenzoic acid
InChI:
InChI=1S/C8H5ClO3/c9-7-5(4-10)2-1-3-6(7)8(11)12/h1-4H,(H,11,12)
InChI Key:
JXFUQVJNPIAUTP-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1Cl)C(=O)O
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.993g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.575g/mol
Monoisotopic Mass:
183.993g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties