AG00I55P

Name: 3-(2-Nitrophenoxy)benzoic acid
Brand: Angene Chemical
SKU: AG00I55P

27237-20-3 | 3-(2-Nitrophenoxy)benzoic acid

AG00I55P

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CAS Number	27237-20-3
Catalog Number	AG00I55P
Chemical Name	3-(2-Nitrophenoxy)benzoic acid
IUPAC Name	3-(2-nitrophenoxy)benzoic acid
InChI	InChI=1S/C13H9NO5/c15-13(16)9-4-3-5-10(8-9)19-12-7-2-1-6-11(12)14(17)18/h1-8H,(H,15,16)
InChI Key	HGFIGLCYOONRCT-UHFFFAOYSA-N
MDL Number	MFCD00690139
Molecular Formula	C13H9NO5
Molecular Weight	259.2143
SMILES	[O-][N+](=O)c1ccccc1Oc1cccc(c1)C(=O)O
Synonyms	3-(2-nitrophenoxy)benzoic acid, 27237-20-3, 3-(2-Nitro-phenoxy)-benzoic acid, benzoic acid, 3-(2-nitrophenoxy)-, BAS 00391502, AC1LES9J, Cambridge id 5492717, Oprea1_145554, Oprea1_572992, MLS000554495, AC1Q214R, CHEMBL1595477, SCHEMBL10594864, CTK8D9843, ZINC62604, HMS2513P09, HMS3377F08, MFCD00690139, STK672672, AKOS000746204, MCULE-8036147305, SMR000171396, ST4026347, AB00087010-01, SR-01000399074, SR-01000399074-1, A1198/0055173, 5492-71-7, Tryptoquivalone, Nortryptoquivalone, Tryptoquivaline B, UNII-3QAI9CTO3Q, C26H24N4O6, AR-1H9147, CID691554, C26-H24-N4-O6, 55387-46-7,

Complexity	340
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	259.048g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	259.217g/mol
Monoisotopic Mass	259.048g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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