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Home > Nitro Compounds > 165254-21-7
165254-21-7 | Benzene, 1,2-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4,5-dinitro-
CAS No: 165254-21-7 Catalog No: AG001W0Q MDL No:
Product Description
Catalog Number:
AG001W0Q
Chemical Name:
Benzene, 1,2-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4,5-dinitro-
CAS Number:
165254-21-7
Molecular Formula:
C20H32N2O12
Molecular Weight:
492.4743
IUPAC Name:
1,2-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-4,5-dinitrobenzene
InChI:
InChI=1S/C20H32N2O12/c1-27-3-5-29-7-9-31-11-13-33-19-15-17(21(23)24)18(22(25)26)16-20(19)34-14-12-32-10-8-30-6-4-28-2/h15-16H,3-14H2,1-2H3
InChI Key:
RLKFEUVQBGLTFI-UHFFFAOYSA-N
SMILES:
COCCOCCOCCOc1cc([N+](=O)[O-])c(cc1OCCOCCOCCOC)[N+](=O)[O-]
UNII:
YB9V0MDTEJ
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
492.196g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
492.478g/mol
Monoisotopic Mass:
492.196g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
166A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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