AG000BHW

1160573-20-5 | Benzaldehyde, 4-chloro-3,5-difluoro-

AG000BHW

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CAS Number	1160573-20-5
Catalog Number	AG000BHW(AGN-PC-0439ZL)
Chemical Name	Benzaldehyde, 4-chloro-3,5-difluoro-
IUPAC Name	4-chloro-3,5-difluorobenzaldehyde
InChI	InChI=1S/C7H3ClF2O/c8-7-5(9)1-4(3-11)2-6(7)10/h1-3H
InChI Key	RFARYBRXGROFNC-UHFFFAOYSA-N
MDL Number	MFCD11553555
Molecular Formula	C7H3ClF2O
Molecular Weight	176.5479
SMILES	O=CC1=CC(F)=C(Cl)C(F)=C1
Synonyms	4-Chloro-3,5-difluorobenzaldehyde, 1160573-20-5, 4-Chloro-3,5-difluoro-benzaldehyde, SCHEMBL6738427, FCH895060, MFCD11553555, ZINC36532791, AKOS006324548, Benzaldehyde, 4-chloro-3,5-difluoro-, JS-5089, AJ-93074, PC302574, Z-2543,

Complexity	141
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	175.984g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	176.547g/mol
Monoisotopic Mass	175.984g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405
UN Code

Certificate of Analysis

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