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Home > Nitro Compounds > 6307-92-2
6307-92-2 | 1,3,5-trinitro-2-(2-phenylethenyl)benzene
CAS No: 6307-92-2 Catalog No: AG00F3LJ MDL No:
Product Description
Catalog Number:
AG00F3LJ
Chemical Name:
1,3,5-trinitro-2-(2-phenylethenyl)benzene
CAS Number:
6307-92-2
IUPAC Name:
1,3,5-trinitro-2-[(E)-2-phenylethenyl]benzene
InChI:
InChI=1S/C14H9N3O6/c18-15(19)11-8-13(16(20)21)12(14(9-11)17(22)23)7-6-10-4-2-1-3-5-10/h1-9H/b7-6+
InChI Key:
JHMMNVQXKFUCCZ-VOTSOKGWSA-N
NSC Number:
43315
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
315.049g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
315.241g/mol
Monoisotopic Mass:
315.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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