Name: Name:1H-Imidazole, 1-(methyl-d3)-2-(1-methylethyl)-5-nitro-
Brand: Angene
SKU: AG0004WE
Rating: 90 (10 reviews)

1H-Imidazole, 1-(methyl-d3)-2-(1-methylethyl)-5-nitro-

CAS No.:

1015855-83-0

Catalog Number:

AG0004WE

Molecular Formula:

C7H8D3N3O2

Molecular Weight:

172.1996

Catalog Number:

AG0004WE

Chemical Name:

1H-Imidazole, 1-(methyl-d3)-2-(1-methylethyl)-5-nitro-

CAS Number:

1015855-83-0

Molecular Formula:

C7H8D3N3O2

Molecular Weight:

172.1996

MDL Number:

MFCD09265284

IUPAC Name:

5-nitro-2-propan-2-yl-1-(trideuteriomethyl)imidazole

InChI:

InChI=1S/C7H11N3O2/c1-5(2)7-8-4-6(9(7)3)10(11)12/h4-5H,1-3H3/i3D3

InChI Key:

NTAFJUSDNOSFFY-HPRDVNIFSA-N

SMILES:

CC(c1ncc(n1C([2H])([2H])[2H])[N+](=O)[O-])C

Complexity:

178

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.104g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.202g/mol

Monoisotopic Mass:

172.104g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1