AG00GSAQ

90940-40-2 | 2-(4-CHLORO-PHENYL)-CYCLOPROPANECARBOXYLIC ACID

AG00GSAQ

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CAS Number	90940-40-2
Catalog Number	AG00GSAQ(AGN-PC-06VLB1)
Chemical Name	2-(4-CHLORO-PHENYL)-CYCLOPROPANECARBOXYLIC ACID
IUPAC Name	2-(4-chlorophenyl)cyclopropane-1-carboxylic acid
InChI	InChI=1S/C10H9ClO2/c11-7-3-1-6(2-4-7)8-5-9(8)10(12)13/h1-4,8-9H,5H2,(H,12,13)
InChI Key	JZYXJKBNUJJIKU-UHFFFAOYSA-N
MDL Number	MFCD03419437
Molecular Formula	C10H9ClO2
Molecular Weight	196.6303
NSC Number	40845
SMILES	O=C(C1C(C2=CC=C(Cl)C=C2)C1)O
Synonyms	90940-40-2, 2-(4-chlorophenyl)cyclopropanecarboxylic acid, 2-(4-Chloro-phenyl)-cyclopropanecarboxylic acid, 2-(4-chlorophenyl)cyclopropane-1-carboxylic acid, NSC40845, ACMC-20n1sc, AC1L5YQQ, 2-(4-Chlorophenyl)cyclopropanecarboxylicAcid, Cyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, cis-, AC1Q74CC, (1S,2S)-2-(4-chlorophenyl)cyclopropane-1-carboxylic acid, Oprea1_498060, SCHEMBL301295, CTK5G8655, JZYXJKBNUJJIKU-UHFFFAOYSA-N, 142796-15-4, 5164AC, MFCD03419437, NSC-40845, SBB018034, STK301557, AKOS000301628, AKOS016042333, MCULE-2373959507, KS-00000D05, AC-29579, AK122406, AM804535, SY036707, TS-02784, TR-038358, BB 0259620, CS-0035601, FT-0678031, ST45061252, MFCD03419437 (95%), Z-0030, Cyclopropanecarboxylic acid, 2-(4-chlorophenyl)-, I04-4859, F2169-0965, 2-(4-Chlorophenyl)cyclopropanecarboxylic acid, AldrichCPR, C10H9ClO2, CID237412,

Complexity	209
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.029g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.63g/mol
Monoisotopic Mass	196.029g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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