CAS
5679-01-6 Purity
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5679-01-6 Purity
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4,5-Dihydroxy-2-hydroxymethyl-1,3,6,8-tetranitroanthraquinone
CAS
567-95-3
Catalog Number
ACM567953
Category
Other Products
Molecular Weight
450.227140 [g/mol]
Molecular Formula
C15H6N4O13
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Specification
Synonyms
EINECS 209-307-6, CID5464178, 4,5-Dihydroxy-2-hydroxymethyl-1,3,6,8-tetranitroanthraquinone, 567-95-3
IUPAC Name
4,5-dihydroxy-2-(hydroxymethyl)-1,3,6,8-tetranitroanthracene-9,10-dione
Canonical SMILES
C1=C(C2=C(C(=C1[N+](=O)[O-])O)C(=O)C3=C(C2=O)C(=C(C(=C3O)[N+](=O)[O-])CO)[N+](=O)[O-])[N+](=O)[O-]
InChI Key
QFCNNIIPXGJBQT-UHFFFAOYSA-N
Boiling Point
774.4ºC at 760mmHg
Flash Point
310.9ºC
Density
2.073g/cm³
EC Number
209-307-6
Exact Mass
449.99300
H-Bond Acceptor
13
H-Bond Donor
3
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