200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 1020718-72-2
1020718-72-2 | Benzaldehyde-2,3,5,6-d4, 4-nitro-
CAS No: 1020718-72-2 Catalog No: AG0006IX MDL No:MFCD04039637
Product Description
Catalog Number:
AG0006IX
Chemical Name:
Benzaldehyde-2,3,5,6-d4, 4-nitro-
CAS Number:
1020718-72-2
Molecular Formula:
C7HD4NO3
Molecular Weight:
155.1441
MDL Number:
MFCD04039637
IUPAC Name:
2,3,5,6-tetradeuterio-4-nitrobenzaldehyde
InChI:
InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H/i1D,2D,3D,4D
InChI Key:
BXRFQSNOROATLV-RHQRLBAQSA-N
SMILES:
O=Cc1c([2H])c([2H])c(c(c1[2H])[2H])[N+](=O)[O-]
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.052g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
4
Molecular Weight:
155.145g/mol
Monoisotopic Mass:
155.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.