200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 85963-24-2
85963-24-2 | 2-Propenoic acid, dinitropropyl ester
CAS No: 85963-24-2 Catalog No: AG004VY5 MDL No:
Product Description
Catalog Number:
AG004VY5
Chemical Name:
2-Propenoic acid, dinitropropyl ester
CAS Number:
85963-24-2
Molecular Formula:
C6H8N2O6
Molecular Weight:
204.1375
IUPAC Name:
3,3-dinitropropyl prop-2-enoate
InChI:
InChI=1S/C6H8N2O6/c1-2-6(9)14-4-3-5(7(10)11)8(12)13/h2,5H,1,3-4H2
InChI Key:
VDDQPZYMXOVQDD-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCCC([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.038g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.138g/mol
Monoisotopic Mass:
204.038g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.