AG00FC73

Name: 3-Nitrocatechol
Brand: Angene Chemical
SKU: AG00FC73

6665-98-1 | 3-Nitrocatechol

AG00FC73

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CAS Number	6665-98-1
Catalog Number	AG00FC73(AGN-PC-0WAJ7S)
Chemical Name	3-Nitrocatechol
IUPAC Name	3-nitrobenzene-1,2-diol
InChI	InChI=1S/C6H5NO4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,8-9H
InChI Key	YHKWFDPEASWKFQ-UHFFFAOYSA-N
MDL Number	MFCD00463758
Molecular Formula	C6H5NO4
Molecular Weight	155.1082
NSC Number	407241
SMILES	OC1=CC=CC([N+]([O-])=O)=C1O
Synonyms	nitrocatechol, 3-nitrobenzene-1,2-diol, 6665-98-1, 3-nitro-1,2-benzenediol, 3-Nitrocatechol, nitrocatechol, 1,2-Benzenediol, nitro-, 3-Nitro-benzene-1,2-diol, AK115051, 30136-15-3, nitrobenzenediol, NSC407241, AC1NEZQD, PubChem23845, 2,3-Dihydroxynitrobenzene, 2,3-dihydroxy-nitrobenzene, SCHEMBL70167, CHEMBL288446, CTK1C0599, YHKWFDPEASWKFQ-UHFFFAOYSA-N, 0237AC, FCH841388, MFCD00463758, SBB087050, STK065233, ZINC35377344, AKOS005071755, AE-0007, CS-W006455, MCULE-5872195506, NSC-407241, OR70151, RP10113, KS-0000220Z, AJ-91356, SC-21674, AB0072050, AX8088551, DB-014316, TR-022522, FT-0681777, ST24042386, Y-9206, 93154-EP2301934A1, 93154-EP2305633A1, 665N981, A835512, I01-9556, J-512969, C6H5NO4, 3-Nitro-benzene-1,2-diol - 1G 1g, CID4675622, C506350,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	155.022g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	155.109g/mol
Monoisotopic Mass	155.022g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	86.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited