Name: Name:1-(5-chloro-2-methoxyphenyl)-4-methylcyclohexane-1-carbonitrile
Brand: Angene
SKU: AG01EJRY
Rating: 90 (10 reviews)

1-(5-chloro-2-methoxyphenyl)-4-methylcyclohexane-1-carbonitrile

CAS No.:

1498754-51-0

Catalog Number:

AG01EJRY

Molecular Formula:

C15H18ClNO

Molecular Weight:

263.7625

Catalog Number:

AG01EJRY

Chemical Name:

1-(5-chloro-2-methoxyphenyl)-4-methylcyclohexane-1-carbonitrile

CAS Number:

1498754-51-0

Molecular Formula:

C15H18ClNO

Molecular Weight:

263.7625

MDL Number:

MFCD21558554

IUPAC Name:

1-(5-chloro-2-methoxyphenyl)-4-methylcyclohexane-1-carbonitrile

InChI:

InChI=1S/C15H18ClNO/c1-11-5-7-15(10-17,8-6-11)13-9-12(16)3-4-14(13)18-2/h3-4,9,11H,5-8H2,1-2H3

InChI Key:

BKPLLLQNBYCDRC-UHFFFAOYSA-N

SMILES:

N#CC1(CCC(CC1)C)c1cc(Cl)ccc1OC

Complexity:

327

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

263.108g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

263.765g/mol

Monoisotopic Mass:

263.108g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

33A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.4