Name: Name:3-(1H-1,2,4-Triazol-1-ylmethyl)aniline
Brand: Angene
SKU: AG000XNG
Rating: 90 (10 reviews)

3-(1H-1,2,4-Triazol-1-ylmethyl)aniline

CAS No.:

127988-22-1

Catalog Number:

AG000XNG

Molecular Formula:

C9H10N4

Molecular Weight:

174.2025

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Purity

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United States

$289

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Catalog Number:

AG000XNG

Chemical Name:

3-(1H-1,2,4-Triazol-1-ylmethyl)aniline

CAS Number:

127988-22-1

Molecular Formula:

C9H10N4

Molecular Weight:

174.2025

MDL Number:

MFCD08060528

IUPAC Name:

3-(1,2,4-triazol-1-ylmethyl)aniline

InChI:

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

InChI Key:

LFINNEVQJQXPHN-UHFFFAOYSA-N

SMILES:

Nc1cccc(c1)Cn1cncn1

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:

56.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2