AG003H0G

392-22-3 | 3-(2-Chloro-6-fluorophenyl)acrylic acid

AG003H0G

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CAS Number	392-22-3
Catalog Number	AG003H0G(AGN-PC-0786JG)
Chemical Name	3-(2-Chloro-6-fluorophenyl)acrylic acid
IUPAC Name	(E)-3-(2-chloro-6-fluorophenyl)prop-2-enoic acid
InChI	InChI=1S/C9H6ClFO2/c10-7-2-1-3-8(11)6(7)4-5-9(12)13/h1-5H,(H,12,13)/b5-4+
InChI Key	NDWALECYVLNBQG-SNAWJCMRSA-N
MDL Number	MFCD00051582
Molecular Formula	C9H6ClFO2
Molecular Weight	200.5941
SMILES	O=C(O)/C=C/C1=C(F)C=CC=C1Cl
Synonyms	2-Chloro-6-fluorocinnamic acid, 392-22-3, 3-(2-Chloro-6-fluorophenyl)acrylic acid, (2E)-3-(2-CHLORO-6-FLUOROPHENYL)ACRYLIC ACID, (2E)-3-(2-chloro-6-fluorophenyl)prop-2-enoic acid, NDWALECYVLNBQG-SNAWJCMRSA-N, MFCD00051582, 3-(2-chloro-6-fluorophenyl)prop-2-enoic acid, (E)-3-(2-chloro-6-fluoro-phenyl)-acrylic acid, J-500750, 2-PROPENOIC ACID, 3-(2-CHLORO-6-FLUOROPHENYL)-, (2E)-, PubChem3430, AC1NT5GK, SCHEMBL1168384, SCHEMBL1168385, RARECHEM BK HW 0069, ZINC152630, ALBB-011734, JRD-1085, ZX-AN010551, ZX-AP002666, 2372AE, ACM392223, BBL034247, PC5447, SBB050857, STL412020, AKOS000263377, AS02744, FCH2256323, FCH3450345, PS-6701, OTAVA-BB 7020400346, 2 - Chloro - 6 - fluorocinnamic acid, NCGC00341511-01, CC-10122, AB0068376, TC-170722, R1816, ST50411808, TRANS-2-CHLORO-6-FLUOROCINNAMIC ACID, (E)-3-(2-chloro-6-fluorophenyl)acrylic acid, (2E)-3-(2-chloro-6-fluorophenyl)-acrylic acid, AB01116973-03, 2-Propenoic acid, 3-(2-chloro-6-fluorophenyl)-, SR-01000071136, (E)-3-(2-chloro-6-fluorophenyl)prop-2-enoic acid, 2-Chloro-6-fluorocinnamic acid, predominantly trans, 3-(2-CHLORO-6-FLUORO-PHENYL)-ACRYLIC ACID, SR-01000071136-1, InChI=1/C9H6ClFO2/c10-7-2-1-3-8(11)6(7)4-5-9(12)13/h1-5H,(H,12,13)/b5-4, C9H6ClFO2, 2-CHLORO-6-FLUOROCINNAMICACID, ACN-042064, CID5324668, 3-(2-chloro-6-fluoro-phenyl)prop-2-enoic Acid,

Complexity	218
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	200.004g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.593g/mol
Monoisotopic Mass	200.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
UN Code

Certificate of Analysis

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