Home Halogens 2-chlorocyclohex-1-enecarbonitrile

2-chlorocyclohex-1-enecarbonitrile

CAS No.:
119205-37-7
Catalog Number:
AG0093V6
Molecular Formula:
C7H8ClN
Molecular Weight:
141.5981
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Product Description
Catalog Number:
AG0093V6
Chemical Name:
2-chlorocyclohex-1-enecarbonitrile
CAS Number:
119205-37-7
Molecular Formula:
C7H8ClN
Molecular Weight:
141.5981
MDL Number:
MFCD11502628
IUPAC Name:
2-chlorocyclohexene-1-carbonitrile
InChI:
InChI=1S/C7H8ClN/c8-7-4-2-1-3-6(7)5-9/h1-4H2
InChI Key:
AFMPUGDGNQTHOQ-UHFFFAOYSA-N
SMILES:
N#CC1=C(Cl)CCCC1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.035g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.598g/mol
Monoisotopic Mass:
141.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties