Name: Name:[3-(4H-1,2,4-triazol-3-yl)phenyl]methanamine
Brand: Angene
SKU: AG01EI9V
Rating: 90 (10 reviews)

[3-(4H-1,2,4-triazol-3-yl)phenyl]methanamine

CAS No.:

1249340-18-8

Catalog Number:

AG01EI9V

Molecular Formula:

C9H10N4

Molecular Weight:

174.2025

Catalog Number:

AG01EI9V

Chemical Name:

[3-(4H-1,2,4-triazol-3-yl)phenyl]methanamine

CAS Number:

1249340-18-8

Molecular Formula:

C9H10N4

Molecular Weight:

174.2025

MDL Number:

MFCD14640940

IUPAC Name:

[3-(1H-1,2,4-triazol-5-yl)phenyl]methanamine

InChI:

InChI=1S/C9H10N4/c10-5-7-2-1-3-8(4-7)9-11-6-12-13-9/h1-4,6H,5,10H2,(H,11,12,13)

InChI Key:

AUKXMWCZHJEYEQ-UHFFFAOYSA-N

SMILES:

NCc1cccc(c1)c1nnc[nH]1

Complexity:

162

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

174.091g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

174.207g/mol

Monoisotopic Mass:

174.091g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5