Name: Name:(4-chloro-3-fluorophenyl)(1H-1,2,3,4-tetrazol-5-yl)methanamine
Brand: Angene
SKU: AG01AC95
Rating: 90 (10 reviews)

(4-chloro-3-fluorophenyl)(1H-1,2,3,4-tetrazol-5-yl)methanamine

CAS No.:

1247472-41-8

Catalog Number:

AG01AC95

Molecular Formula:

C8H7ClFN5

Molecular Weight:

227.6261

Catalog Number:

AG01AC95

Chemical Name:

(4-chloro-3-fluorophenyl)(1H-1,2,3,4-tetrazol-5-yl)methanamine

CAS Number:

1247472-41-8

Molecular Formula:

C8H7ClFN5

Molecular Weight:

227.6261

MDL Number:

MFCD16040268

IUPAC Name:

(4-chloro-3-fluorophenyl)-(2H-tetrazol-5-yl)methanamine

InChI:

InChI=1S/C8H7ClFN5/c9-5-2-1-4(3-6(5)10)7(11)8-12-14-15-13-8/h1-3,7H,11H2,(H,12,13,14,15)

InChI Key:

FDTYKSPBTLKLGK-UHFFFAOYSA-N

SMILES:

Clc1ccc(cc1F)C(c1nnn[nH]1)N

Complexity:

219

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

227.037g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

227.627g/mol

Monoisotopic Mass:

227.037g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

80.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8