AG001TDA

162744-55-0 | Benzenemethanol, 4-bromo-2,3-difluoro-

AG001TDA

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CAS Number	162744-55-0
Catalog Number	AG001TDA(AGN-PC-0H3Z07)
Chemical Name	Benzenemethanol, 4-bromo-2,3-difluoro-
IUPAC Name	(4-bromo-2,3-difluorophenyl)methanol
InChI	InChI=1S/C7H5BrF2O/c8-5-2-1-4(3-11)6(9)7(5)10/h1-2,11H,3H2
InChI Key	QUNPEOZOKHEQDK-UHFFFAOYSA-N
MDL Number	MFCD22493515
Molecular Formula	C7H5BrF2O
Molecular Weight	223.0148
SMILES	OCC1=CC=C(Br)C(F)=C1F
Synonyms	(4-bromo-2,3-difluorophenyl)methanol, 162744-55-0, 4-bromo-2,3-difluorobenzyl alcohol, Benzenemethanol, 4-bromo-2,3-difluoro-, SCHEMBL855176, QUNPEOZOKHEQDK-UHFFFAOYSA-N, MFCD22493515, ZINC98210635, AKOS027252277, PS-10179, AS-813/43501824, Z2692093543,

Complexity	134
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.949g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	223.017g/mol
Monoisotopic Mass	221.949g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H320-H335
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

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