Home Halogens (2-chloro-3,4-dimethoxyphenyl)acetonitrile

(2-chloro-3,4-dimethoxyphenyl)acetonitrile

CAS No.:
7537-07-7
Catalog Number:
AG00GNHJ
Molecular Formula:
C10H10ClNO2
Molecular Weight:
211.6449
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Product Description
Catalog Number:
AG00GNHJ
Chemical Name:
(2-chloro-3,4-dimethoxyphenyl)acetonitrile
CAS Number:
7537-07-7
Molecular Formula:
C10H10ClNO2
Molecular Weight:
211.6449
MDL Number:
MFCD13516980
IUPAC Name:
2-(2-chloro-3,4-dimethoxyphenyl)acetonitrile
InChI:
InChI=1S/C10H10ClNO2/c1-13-8-4-3-7(5-6-12)9(11)10(8)14-2/h3-4H,5H2,1-2H3
InChI Key:
OHKWPKQYDBARHV-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(c(c1Cl)OC)OC
EC Number:
231-407-3
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.645g/mol
Monoisotopic Mass:
211.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties