Name: Name:3-Bromo-5-phenyl-1H-1,2,4-triazole
Brand: Angene
SKU: AG001PPH
Rating: 90 (10 reviews)

3-Bromo-5-phenyl-1H-1,2,4-triazole

CAS No.:

15777-59-0

Catalog Number:

AG001PPH

Molecular Formula:

C8H6BrN3

Molecular Weight:

224.0573

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

95%

In Stock USA

United States

$448

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95%

In Stock USA

United States

$1462

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Catalog Number:

AG001PPH

Chemical Name:

3-Bromo-5-phenyl-1H-1,2,4-triazole

CAS Number:

15777-59-0

Molecular Formula:

C8H6BrN3

Molecular Weight:

224.0573

MDL Number:

MFCD13188619

IUPAC Name:

5-bromo-3-phenyl-1H-1,2,4-triazole

InChI:

InChI=1S/C8H6BrN3/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H,10,11,12)

InChI Key:

SIQJGSXGBGMSOQ-UHFFFAOYSA-N

SMILES:

Brc1[nH]nc(n1)c1ccccc1

Complexity:

147

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

222.975g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

224.061g/mol

Monoisotopic Mass:

222.975g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7