Name: Name:Trans-4-(4-heptylcyclohexyl)benzonitrile
Brand: Angene
SKU: AG00EFFS
Rating: 90 (10 reviews)

Trans-4-(4-heptylcyclohexyl)benzonitrile

CAS No.:

61204-03-3

Catalog Number:

AG00EFFS

Molecular Formula:

C20H29N

Molecular Weight:

283.4510

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Purity

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United States

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Catalog Number:

AG00EFFS

Chemical Name:

Trans-4-(4-heptylcyclohexyl)benzonitrile

CAS Number:

61204-03-3

Molecular Formula:

C20H29N

Molecular Weight:

283.4510

MDL Number:

MFCD01941020

IUPAC Name:

4-(4-heptylcyclohexyl)benzonitrile

InChI:

InChI=1S/C20H29N/c1-2-3-4-5-6-7-17-8-12-19(13-9-17)20-14-10-18(16-21)11-15-20/h10-11,14-15,17,19H,2-9,12-13H2,1H3

InChI Key:

NSGMZTNTQKRAFA-UHFFFAOYSA-N

SMILES:

CCCCCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)C#N

EC Number:

262-658-7

Complexity:

310

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

283.23g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

283.459g/mol

Monoisotopic Mass:

283.23g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

23.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.7