Name: Name:2-chloro-7,7-dimethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Brand: Angene
SKU: AG01DWWR
Rating: 90 (10 reviews)

2-chloro-7,7-dimethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

CAS No.:

952569-57-2

Catalog Number:

AG01DWWR

Molecular Formula:

C12H13ClN2

Molecular Weight:

220.6980

Catalog Number:

AG01DWWR

Chemical Name:

2-chloro-7,7-dimethyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile

CAS Number:

952569-57-2

Molecular Formula:

C12H13ClN2

Molecular Weight:

220.6980

MDL Number:

MFCD03426879

IUPAC Name:

2-chloro-7,7-dimethyl-6,8-dihydro-5H-quinoline-3-carbonitrile

InChI:

InChI=1S/C12H13ClN2/c1-12(2)4-3-8-5-9(7-14)11(13)15-10(8)6-12/h5H,3-4,6H2,1-2H3

InChI Key:

RKICFLPSLQJSMF-UHFFFAOYSA-N

SMILES:

N#Cc1cc2CCC(Cc2nc1Cl)(C)C

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.7g/mol

Monoisotopic Mass:

220.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

36.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.6