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Structure

2,4-Dichloro-3,5-dinitrobenzoic acid

CAS
52729-03-0
Catalog Number
ACM52729030
Category
Other Products
Molecular Weight
281.01
Molecular Formula
C7H2Cl2N2O6

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Specification

Synonyms
D60850_ALDRICH, NSC76602, 2,4-Dichloro-3,5-dinitrobenzoic acid, CID96497, EINECS 258-136-3, ST5308118, 2,4-DICHLORO 3,5-DINITROBENZOIC ACID, 52729-03-0, InChI=1/C7H2Cl2N2O6/c8-4-2(7(12)13)1-3(10(14)15)5(9)6(4)11(16)17/h1H,(H,12,13
IUPAC Name
2,4-dichloro-3,5-dinitrobenzoic acid
Canonical SMILES
C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)C(=O)O
InChI Key
OCJYCLPVZHBZRL-UHFFFAOYSA-N
Boiling Point
433.7ºC at 760mmHg
Melting Point
212-213ºC(lit.)
Flash Point
216.1ºC
Density
1.879g/cm³
Appearance
yellow crystalline powder
EC Number
258-136-3
Exact Mass
279.92900
Hazard Statements
Xi
H-Bond Acceptor
6
H-Bond Donor
1
Safety Description
S22-S24/25
WGK Germany
3
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