Name: Name:Benzonitrile, 3-[(1R)-1-aminopropyl]-, hydrochloride (1:1)
Brand: Angene
SKU: AG000NLJ
Rating: 90 (10 reviews)

Benzonitrile, 3-[(1R)-1-aminopropyl]-, hydrochloride (1:1)

CAS No.:

1253792-93-6

Catalog Number:

AG000NLJ

Molecular Formula:

C10H13ClN2

Molecular Weight:

196.6766

Catalog Number:

AG000NLJ

Chemical Name:

Benzonitrile, 3-[(1R)-1-aminopropyl]-, hydrochloride (1:1)

CAS Number:

1253792-93-6

Molecular Formula:

C10H13ClN2

Molecular Weight:

196.6766

MDL Number:

MFCD16295020

IUPAC Name:

3-[(1R)-1-aminopropyl]benzonitrile;hydrochloride

InChI:

InChI=1S/C10H12N2.ClH/c1-2-10(12)9-5-3-4-8(6-9)7-11;/h3-6,10H,2,12H2,1H3;1H/t10-;/m1./s1

InChI Key:

XTSNURVDNKGGJE-HNCPQSOCSA-N

SMILES:

CC[C@H](c1cccc(c1)C#N)N.Cl

Complexity:

180

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.077g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.678g/mol

Monoisotopic Mass:

196.077g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

49.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: