Name: Name:[(4-chlorophenyl)methyl][(1-methyl-1H-pyrazol-4-yl)methyl]amine
Brand: Angene
SKU: AG01BHN5
Rating: 90 (10 reviews)

[(4-chlorophenyl)methyl][(1-methyl-1H-pyrazol-4-yl)methyl]amine

CAS No.:

1152953-78-0

Catalog Number:

AG01BHN5

Molecular Formula:

C12H14ClN3

Molecular Weight:

235.7127

Catalog Number:

AG01BHN5

Chemical Name:

[(4-chlorophenyl)methyl][(1-methyl-1H-pyrazol-4-yl)methyl]amine

CAS Number:

1152953-78-0

Molecular Formula:

C12H14ClN3

Molecular Weight:

235.7127

MDL Number:

MFCD11167547

IUPAC Name:

1-(4-chlorophenyl)-N-[(1-methylpyrazol-4-yl)methyl]methanamine

InChI:

InChI=1S/C12H14ClN3/c1-16-9-11(8-15-16)7-14-6-10-2-4-12(13)5-3-10/h2-5,8-9,14H,6-7H2,1H3

InChI Key:

ABBTVAABEMTFDY-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1)CNCc1cnn(c1)C

Complexity:

204

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

235.088g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

235.715g/mol

Monoisotopic Mass:

235.088g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7