Home Halogens 7-chloro-2,3-dihydro-1H-indene-1-carbonitrile

7-chloro-2,3-dihydro-1H-indene-1-carbonitrile

CAS No.:
1429233-89-5
Catalog Number:
AG01DIWO
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
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Product Description
Catalog Number:
AG01DIWO
Chemical Name:
7-chloro-2,3-dihydro-1H-indene-1-carbonitrile
CAS Number:
1429233-89-5
Molecular Formula:
C10H8ClN
Molecular Weight:
177.6302
IUPAC Name:
7-chloro-2,3-dihydro-1H-indene-1-carbonitrile
InChI:
InChI=1S/C10H8ClN/c11-9-3-1-2-7-4-5-8(6-12)10(7)9/h1-3,8H,4-5H2
InChI Key:
RLNHDHLVDOIMLY-UHFFFAOYSA-N
SMILES:
N#CC1CCc2c1c(Cl)ccc2
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.631g/mol
Monoisotopic Mass:
177.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties