AG0021OG

Name: 1-(3-nitrophenyl)cyclobutanecarboxylic acid
Brand: Angene Chemical
SKU: AG0021OG

180080-87-9 | 1-(3-nitrophenyl)cyclobutanecarboxylic acid

AG0021OG

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CAS Number	180080-87-9
Catalog Number	AG0021OG(AGN-PC-01YZCM)
Chemical Name	1-(3-nitrophenyl)cyclobutanecarboxylic acid
IUPAC Name	1-(3-nitrophenyl)cyclobutane-1-carboxylic acid
InChI	InChI=1S/C11H11NO4/c13-10(14)11(5-2-6-11)8-3-1-4-9(7-8)12(15)16/h1,3-4,7H,2,5-6H2,(H,13,14)
InChI Key	QBUXPHKPYHXRST-UHFFFAOYSA-N
MDL Number	MFCD11037074
Molecular Formula	C11H11NO4
Molecular Weight	221.2093
SMILES	OC(C1(C2=CC([N+]([O-])=O)=CC=C2)CCC1)=O
Synonyms	1-(3-NITROPHENYL)CYCLOBUTANECARBOXYLIC ACID, 180080-87-9, SCHEMBL6676255, QBUXPHKPYHXRST-UHFFFAOYSA-N, MFCD11037074, ZINC59673279, AKOS024464725, AB62754, CS-W000518, AK162772, AS-30937, AX8294786, Cyclobutanecarboxylic acid, 1-(3-nitrophenyl)-,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.069g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.212g/mol
Monoisotopic Mass	221.069g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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