AG0064WP

99585-10-1 | 3-Chloro-4-ethoxybenzaldehyde

AG0064WP

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CAS Number	99585-10-1
Catalog Number	AG0064WP(AGN-PC-0LH0OZ)
Chemical Name	3-Chloro-4-ethoxybenzaldehyde
IUPAC Name	3-chloro-4-ethoxybenzaldehyde
InChI	InChI=1S/C9H9ClO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-6H,2H2,1H3
InChI Key	ZYDPBMFCTQAEMR-UHFFFAOYSA-N
MDL Number	MFCD06246171
Molecular Formula	C9H9ClO2
Molecular Weight	184.6196
SMILES	O=CC1=CC=C(OCC)C(Cl)=C1
Synonyms	3-chloro-4-ethoxybenzaldehyde, 99585-10-1, 3-chloro-4-ethoxy-benzaldehyde, AC1NHRSG, SCHEMBL566725, CTK5I0526, DTXSID70406378, ZYDPBMFCTQAEMR-UHFFFAOYSA-N, Benzaldehyde, 3-chloro-4-ethoxy-, CHEMBRDG-BB 4015100, ZINC8324613, 4706AF, BBL023770, KM3508, MFCD06246171, STL289228, AKOS000111492, MCULE-6697005238, AJ-57451, 3-Chloro-4-ethoxybenzaldehyde, AldrichCPR, TR-030459, BB 0241776, FT-0681562, I01-14048, 2,6-Piperazinedione, C9H9ClO2, CHEMBRDG-BB4015100, CID4770035,

Complexity	150
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	184.029g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	184.619g/mol
Monoisotopic Mass	184.029g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
UN Code

Certificate of Analysis

Lot Number