Name: Name:4-bromo-2,6-dimethyl-N-(1H-pyrazol-3-ylmethyl)aniline
Brand: Angene
SKU: AG01A623
Rating: 90 (10 reviews)

4-bromo-2,6-dimethyl-N-(1H-pyrazol-3-ylmethyl)aniline

CAS No.:

1179608-96-8

Catalog Number:

AG01A623

Molecular Formula:

C12H14BrN3

Molecular Weight:

280.1637

Catalog Number:

AG01A623

Chemical Name:

4-bromo-2,6-dimethyl-N-(1H-pyrazol-3-ylmethyl)aniline

CAS Number:

1179608-96-8

Molecular Formula:

C12H14BrN3

Molecular Weight:

280.1637

MDL Number:

MFCD12808380

IUPAC Name:

4-bromo-2,6-dimethyl-N-(1H-pyrazol-5-ylmethyl)aniline

InChI:

InChI=1S/C12H14BrN3/c1-8-5-10(13)6-9(2)12(8)14-7-11-3-4-15-16-11/h3-6,14H,7H2,1-2H3,(H,15,16)

InChI Key:

ZCCJXTUBCLCCFT-UHFFFAOYSA-N

SMILES:

Cc1cc(Br)cc(c1NCc1cc[nH]n1)C

Complexity:

212

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

279.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.169g/mol

Monoisotopic Mass:

279.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

40.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.1