AG0001BN

1002344-97-9 | 4-Chloro-2-fluoro-3-methoxybenzaldehyde

AG0001BN

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CAS Number	1002344-97-9
Catalog Number	AG0001BN(AGN-PC-0WAOTA)
Chemical Name	4-Chloro-2-fluoro-3-methoxybenzaldehyde
IUPAC Name	4-chloro-2-fluoro-3-methoxybenzaldehyde
InChI	InChI=1S/C8H6ClFO2/c1-12-8-6(9)3-2-5(4-11)7(8)10/h2-4H,1H3
InChI Key	LFDRRVSSSZUDJD-UHFFFAOYSA-N
MDL Number	MFCD19687172
Molecular Formula	C8H6ClFO2
Molecular Weight	188.5834
SMILES	ClC1=C(C(=C(C=O)C=C1)F)OC
Synonyms	4-CHLORO-2-FLUORO-3-METHOXYBENZALDEHYDE, 1002344-97-9, MFCD19687172, SCHEMBL1397054, KS-00001AHY, LFDRRVSSSZUDJD-UHFFFAOYSA-N, ZINC91251995, AKOS015957175, FCH1192440, JS-4942, AM806124, PC302973, AJ-129215, AX8285132, Benzaldehyde, 4-chloro-2-fluoro-3-methoxy-,

Complexity	165
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.004g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.582g/mol
Monoisotopic Mass	188.004g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

GHS Hazard and Precautionary Statements

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

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