AG00DVZ3

462-23-7 | 4-Fluorobutyric acid

AG00DVZ3

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CAS Number	462-23-7
Catalog Number	AG00DVZ3(AGN-PC-0JK9JM)
Chemical Name	4-Fluorobutyric acid
IUPAC Name	4-fluorobutanoic acid
InChI	InChI=1S/C4H7FO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7)
InChI Key	BDXSWIQVLYXSSU-UHFFFAOYSA-N
MDL Number	MFCD17014695
Molecular Formula	C4H7FO2
Molecular Weight	106.0956
SMILES	OC(CCCF)=O
Synonyms	4-fluorobutanoic Acid, 462-23-7, 4-FLUOROBUTYRIC ACID, Butanoic acid,4-fluoro-, AC1L1V55, SCHEMBL1031829, CTK4I9253, DTXSID60274508, ZINC2040423, AKOS006380509, 4-Fluorobutyricacid, CID10411,

Complexity	62.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	106.043g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	106.096g/mol
Monoisotopic Mass	106.043g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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