CAS
57605-95-5 Purity
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57605-95-5 Purity
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2-Methyl-1,3,5-trinitrobenzene; 1,3,5,7-tetranitro-1,3,5,7-tetrazocane
CAS
57607-37-1
Catalog Number
ACM57607371
Category
Other Products
Molecular Weight
523.286 g/mol
Molecular Formula
C11H13N11O14
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Specification
Synonyms
UN0266; Cyclotetramethylenetetranitramine mixt. with trinitrotoluene; Octol; Octol 60/40; PBH 9; Octol 76/23; Octol A; Octolite;
IUPAC Name
2-methyl-1,3,5-trinitrobenzene;1,3,5,7-tetranitro-1,3,5,7-tetrazocane
Canonical SMILES
CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-].C1N(CN(CN(CN1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI Key
UPSVYNDQEVZTMB-UHFFFAOYSA-N
Exact Mass
523.06400
H-Bond Acceptor
18
H-Bond Donor
0
UN Number
266
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