Name: Name:5-[(2-nitrophenyl)methyl]-1H-1,2,3,4-tetrazole
Brand: Angene
SKU: AG01A1J7
Rating: 90 (10 reviews)

5-[(2-nitrophenyl)methyl]-1H-1,2,3,4-tetrazole

CAS No.:

177595-29-8

Catalog Number:

AG01A1J7

Molecular Formula:

C8H7N5O2

Molecular Weight:

205.1735

Catalog Number:

AG01A1J7

Chemical Name:

5-[(2-nitrophenyl)methyl]-1H-1,2,3,4-tetrazole

CAS Number:

177595-29-8

Molecular Formula:

C8H7N5O2

Molecular Weight:

205.1735

MDL Number:

MFCD11156004

IUPAC Name:

5-[(2-nitrophenyl)methyl]-2H-tetrazole

InChI:

InChI=1S/C8H7N5O2/c14-13(15)7-4-2-1-3-6(7)5-8-9-11-12-10-8/h1-4H,5H2,(H,9,10,11,12)

InChI Key:

QTFPZDIGKYZDMI-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1ccccc1Cc1nnn[nH]1

Complexity:

232

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

205.06g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

205.177g/mol

Monoisotopic Mass:

205.06g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3