AG004S9S

847502-88-9 | 2,4-Difluoro-3-methylbenzaldehyde

AG004S9S

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CAS Number	847502-88-9
Catalog Number	AG004S9S(AGN-PC-0NHWFY)
Chemical Name	2,4-Difluoro-3-methylbenzaldehyde
IUPAC Name	2,4-difluoro-3-methylbenzaldehyde
InChI	InChI=1S/C8H6F2O/c1-5-7(9)3-2-6(4-11)8(5)10/h2-4H,1H3
InChI Key	MPOSIFXAXWZQED-UHFFFAOYSA-N
MDL Number	MFCD07777152
Molecular Formula	C8H6F2O
Molecular Weight	156.1294
SMILES	CC1=C(F)C(C=O)=CC=C1F
Synonyms	2,4-DIFLUORO-3-METHYLBENZALDEHYDE, 847502-88-9, Benzaldehyde, 2,4-difluoro-3-methyl-, AK-80097, PubChem17004, KSC495S7L, SCHEMBL584614, CTK3J5975, DTXSID90478299, MPOSIFXAXWZQED-UHFFFAOYSA-N, ACT03512, 2,4-difluoro-3-methyl-benzaldehyde, ANW-44302, CL8245, FC1198, FCH921526, MFCD07777152, ZINC12359160, AKOS005255017, AM61656, DS-2080, MP-0807, RP22012, RTR-026182, AJ-61394, CJ-13872, AB0064173, AX8066837, DB-005859, ST2415796, TR-026182, 4CH-014822, FT-0081532, FT-0651176, Z5177, J-507201, C8H6F2O, A10165,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.039g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	156.132g/mol
Monoisotopic Mass	156.039g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^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-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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