Name: Name:N-Benzyl-3-bromo-1-methyl-4-nitro-1H-pyrazol-5-amine
Brand: Angene
SKU: AG00HYC6
Rating: 90 (10 reviews)

N-Benzyl-3-bromo-1-methyl-4-nitro-1H-pyrazol-5-amine

CAS No.:

155601-07-3

Catalog Number:

AG00HYC6

Molecular Formula:

C11H11BrN4O2

Molecular Weight:

311.1346

Catalog Number:

AG00HYC6

Chemical Name:

N-Benzyl-3-bromo-1-methyl-4-nitro-1H-pyrazol-5-amine

CAS Number:

155601-07-3

Molecular Formula:

C11H11BrN4O2

Molecular Weight:

311.1346

MDL Number:

MFCD30180246

IUPAC Name:

N-benzyl-5-bromo-2-methyl-4-nitropyrazol-3-amine

InChI:

InChI=1S/C11H11BrN4O2/c1-15-11(9(16(17)18)10(12)14-15)13-7-8-5-3-2-4-6-8/h2-6,13H,7H2,1H3

InChI Key:

ZHGKIYFHDLVZIM-UHFFFAOYSA-N

SMILES:

Cn1nc(c(c1NCc1ccccc1)N(=O)=O)Br

Complexity:

293

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

310.007g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

311.139g/mol

Monoisotopic Mass:

310.007g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4