AG00FFCI

Name: 2-(Methoxycarbonyl)-3-nitrobenzoic acid
Brand: Angene Chemical
SKU: AG00FFCI

6744-85-0 | 2-(Methoxycarbonyl)-3-nitrobenzoic acid

AG00FFCI

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CAS Number	6744-85-0
Catalog Number	AG00FFCI(AGN-PC-0LEJ15)
Chemical Name	2-(Methoxycarbonyl)-3-nitrobenzoic acid
IUPAC Name	2-methoxycarbonyl-3-nitrobenzoic acid
InChI	InChI=1S/C9H7NO6/c1-16-9(13)7-5(8(11)12)3-2-4-6(7)10(14)15/h2-4H,1H3,(H,11,12)
InChI Key	UTEQVEMDYYOJGM-UHFFFAOYSA-N
MDL Number	MFCD00090729
Molecular Formula	C9H7NO6
Molecular Weight	225.1550
NSC Number	52151
SMILES	COC(=O)c1c(cccc1[N+](=O)[O-])C(=O)O
Synonyms	2-(methoxycarbonyl)-3-nitrobenzoic acid, 6744-85-0, 3-Nitro-phthalic acid 2-methyl ester, NSC52151, AC1L6AMV, AC1Q42DI, AC1Q5AU9, Oprea1_275812, Oprea1_656052, SCHEMBL4415542, CTK5C6177, DTXSID90287681, UTEQVEMDYYOJGM-UHFFFAOYSA-N, ZINC469054, 0373AC, MFCD00090729, NSC-52151, STL230916, 2-methoxycarbonyl-3-nitrobenzoic acid, 3-nitro-phthalic acid-2-methyl ester, AKOS002687654, 2-methoxycarbonyl-3-nitro-benzoic acid, AN-4709, MCULE-2929925358, AJ-23065, DA-04432, AB0190641, AX8246092, FT-0701627, ST45182369, W-2952, C9H7NO6, AR-1C9430, CID243002, 2-(Methoxycarbonyl)-3-nitrobenzoicacid, 78090-11-6,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.027g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.156g/mol
Monoisotopic Mass	225.027g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	109A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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