AG00252W

177034-25-2 | Benzaldehyde, 2,4-difluoro-5-methoxy-

AG00252W

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CAS Number	177034-25-2
Catalog Number	AG00252W(AGN-PC-0BWPHL)
Chemical Name	Benzaldehyde, 2,4-difluoro-5-methoxy-
IUPAC Name	2,4-difluoro-5-methoxybenzaldehyde
InChI	InChI=1S/C8H6F2O2/c1-12-8-2-5(4-11)6(9)3-7(8)10/h2-4H,1H3
InChI Key	UHJQBMHEDSFVHM-UHFFFAOYSA-N
MDL Number	MFCD24539280
Molecular Formula	C8H6F2O2
Molecular Weight	172.1288
SMILES	O=CC1=CC(OC)=C(F)C=C1F
Synonyms	2,4-Difluoro-5-methoxybenzaldehyde, 177034-25-2, Benzaldehyde, 2,4-difluoro-5-methoxy-, SCHEMBL2915368, CTK0E3666, DTXSID60727963, UHJQBMHEDSFVHM-UHFFFAOYSA-N, KS-00000B3E, 5341AJ, MFCD24539280, ZINC90525572, AKOS025243170, FCH2005143, TRA0030208, AS-32396, SY027572, FT-0722807, Z-3733, MFCD24539280 (97+%), C8H6F2O2,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.034g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	172.131g/mol
Monoisotopic Mass	172.034g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P261-P280-P305+P351+P338-P304+P340-P405-P501
UN Code

Certificate of Analysis

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