Home Halogens 3-chloro-1,5-dimethyl-1H-pyrrole-2-carbonitrile

3-chloro-1,5-dimethyl-1H-pyrrole-2-carbonitrile

CAS No.:
1881332-74-6
Catalog Number:
AG00I2QG
Molecular Formula:
C7H7ClN2
Molecular Weight:
154.5969
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Product Description
Catalog Number:
AG00I2QG
Chemical Name:
3-chloro-1,5-dimethyl-1H-pyrrole-2-carbonitrile
CAS Number:
1881332-74-6
Molecular Formula:
C7H7ClN2
Molecular Weight:
154.5969
MDL Number:
MFCD29044036
IUPAC Name:
3-chloro-1,5-dimethylpyrrole-2-carbonitrile
InChI:
InChI=1S/C7H7ClN2/c1-5-3-6(8)7(4-9)10(5)2/h3H,1-2H3
InChI Key:
GOUZOMYZHVVEGV-UHFFFAOYSA-N
SMILES:
N#Cc1c(Cl)cc(n1C)C
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.03g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.597g/mol
Monoisotopic Mass:
154.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties