3-Nitro-1,2-benzenediol supplier

Name
3-Nitrocatechol
EINECS
CAS No. 6665-98-1
Article Data34
CAS DataBase
Density 1.58g/cm³
Solubility 14.88g/L(20.5 oC)
Melting Point
Formula C6H5 N O4
Boiling Point 268.6°C at 760 mmHg
Molecular Weight 155.11
Flash Point 123.7°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Pyrocatechol,3-nitro- (6CI,7CI,8CI); 1,2-Dihydroxy-3-nitrobenzene;2,3-Dihydroxynitrobenzene; 2-Hydroxy-3-nitrophenol; 3-Nitro-1,2-benzenediol;3-Nitrocatechol; 3-Nitropyrocatechol; NSC 407241
PSA 86.28000
LogP 1.52920

3-Nitro-1,2-benzenediol Chemical Properties

Molecular Structure of 3-Nitro-1,2-benzenediol (CAS NO.6665-98-1):

IUPAC Name: 3-Nitrobenzene-1,2-diol
Canonical SMILES: C1=CC(=C(C(=C1)O)O)[N+](=O)[O-]
InChI: InChI=1S/C6H5NO4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,8-9H
InChIKey: YHKWFDPEASWKFQ-UHFFFAOYSA-N
Molecular Weight: 155.1082 [g/mol]
Molecular Formula: C₆H₅NO₄
XLogP3: 1.2
H-Bond Donor: 2
H-Bond Acceptor: 4
Rotatable Bond Count: 0
Tautomer Count: 13
Exact Mass: 155.021858
MonoIsotopic Mass: 155.021858
Topological Polar Surface Area: 86.3
Heavy Atom Count: 11
Complexity: 155
Index of Refraction: 1.667
Molar Refractivity: 36.56 cm³
Molar Volume: 98.1 cm³
Surface Tension: 79.2 dyne/cm
Density: 1.58 g/cm³
Flash Point: 123.7 °C
Enthalpy of Vaporization: 52.71 kJ/mol
Boiling Point: 268.6 °C at 760 mmHg
Vapour Pressure: 0.00461 mmHg at 25 °C

3-Nitro-1,2-benzenediol Specification

3-Nitro-1,2-benzenediol (CAS NO.6665-98-1), its Synonyms are 3-Nitro-benzene-1,2-diol ; 3-Nitrocatechol ; 1,2-Benzenediol, 3-nitro- .

Product Name

3-Nitrocatechol

3-Nitro-1,2-benzenediol Chemical Properties

3-Nitro-1,2-benzenediol Specification

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