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Home > Nitro Compounds > 3156-41-0
3156-41-0 | BETA,4-DINITROSTYRENE
CAS No: 3156-41-0 Catalog No: AG003O5X MDL No:MFCD00052058
Product Description
Catalog Number:
AG003O5X
Chemical Name:
BETA,4-DINITROSTYRENE
CAS Number:
3156-41-0
MDL Number:
MFCD00052058
IUPAC Name:
1-nitro-4-[(E)-2-nitroethenyl]benzene
InChI:
InChI=1S/C8H6N2O4/c11-9(12)6-5-7-1-3-8(4-2-7)10(13)14/h1-6H/b6-5+
InChI Key:
HABXLWPUIWFTNM-AATRIKPKSA-N
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
194.033g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.146g/mol
Monoisotopic Mass:
194.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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