AG004RHV

872422-15-6 | 1-(4-Bromo-2-fluorophenyl)cyclopropanecarboxylic acid

AG004RHV

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CAS Number	872422-15-6
Catalog Number	AG004RHV(AGN-PC-0WAMX3)
Chemical Name	1-(4-Bromo-2-fluorophenyl)cyclopropanecarboxylic acid
IUPAC Name	1-(4-bromo-2-fluorophenyl)cyclopropane-1-carboxylic acid
InChI	InChI=1S/C10H8BrFO2/c11-6-1-2-7(8(12)5-6)10(3-4-10)9(13)14/h1-2,5H,3-4H2,(H,13,14)
InChI Key	UPADMCJEKQAEKT-UHFFFAOYSA-N
MDL Number	MFCD12405622
Molecular Formula	C10H8BrFO2
Molecular Weight	259.0717
SMILES	O=C(C1(C2=CC=C(Br)C=C2F)CC1)O
Synonyms	872422-15-6, 1-(4-Bromo-2-fluorophenyl)cyclopropanecarboxylic acid, 1-(4-Bromo-2-fluorophenyl)cyclopropane-1-carboxylic acid, ACMC-209qj5, C10H8BrFO2, SCHEMBL351360, CTK8B2527, DTXSID50735537, UPADMCJEKQAEKT-UHFFFAOYSA-N, KS-00000QR4, ANW-38655, MFCD12405622, ZINC75934277, AKOS016001004, FCH1328444, AK-95267, DA-41020, DS-18023, SY225678, AJ-122119, AX8239992, TC-127400, CS-0041363, FT-0705102, V8414, MFCD12405622 (95%), Cyclopropanecarboxylic acid, 1-(4-bromo-2-fluorophenyl)-, 1-(4-Bromo-2-fluorophenyl)cyclopropanecarboxylicacid, 1-(4-Bromo-2-fluorophenyl)cyclopropanecarboxylic acid,

Complexity	253
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	257.969g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	259.074g/mol
Monoisotopic Mass	257.969g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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