Name: Name:4-(4-Cyanobenzyl)-1,2,4-triazole
Brand: Angene
SKU: AG0081SA
Rating: 90 (10 reviews)

4-(4-Cyanobenzyl)-1,2,4-triazole

CAS No.:

112809-27-5

Catalog Number:

AG0081SA

Molecular Formula:

C10H8N4

Molecular Weight:

184.1973

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

250mg

95%

1 week

United States

$238

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Catalog Number:

AG0081SA

Chemical Name:

4-(4-Cyanobenzyl)-1,2,4-triazole

CAS Number:

112809-27-5

Molecular Formula:

C10H8N4

Molecular Weight:

184.1973

MDL Number:

MFCD09743818

IUPAC Name:

4-(1,2,4-triazol-4-ylmethyl)benzonitrile

InChI:

InChI=1S/C10H8N4/c11-5-9-1-3-10(4-2-9)6-14-7-12-13-8-14/h1-4,7-8H,6H2

InChI Key:

BCSZNBYWPPFADT-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(cc1)Cn1cnnc1

Complexity:

218

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

184.075g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

184.202g/mol

Monoisotopic Mass:

184.075g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5