AG003IIJ

5973-71-7 | 3,4-Dimethylbenzaldehyde

AG003IIJ

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CAS Number	5973-71-7
Catalog Number	AG003IIJ(AGN-PC-0CF54U)
Chemical Name	3,4-Dimethylbenzaldehyde
EC Number	227-770-2
IUPAC Name	3,4-dimethylbenzaldehyde
InChI	InChI=1S/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3
InChI Key	POQJHLBMLVTHAU-UHFFFAOYSA-N
MDL Number	MFCD00016612
Molecular Formula	C9H10O
Molecular Weight	134.1751
SMILES	C(=O)c1cc(C)c(cc1)C
UNII	16G1J12ARB
Synonyms	2,5-dimethylbenzaldehyde, 3,4-dimethylbenzaldehyde, DMB-aldehyde, 3,4-DIMETHYLBENZALDEHYDE, 5973-71-7, Benzaldehyde, 3,4-dimethyl-, UNII-16G1J12ARB, MFCD00016612, 4-Formyl-o-xylene, o-Xylene-4-carboxaldehyde, 3,4-DiMethyl-Benzaldehyde, 16G1J12ARB, 3 pound not4-dimethylbenzaldehyde, POQJHLBMLVTHAU-UHFFFAOYSA-N, 3,4-Dimethylbenzaldehyde, 97%, EINECS 227-770-2, PubChem2535, AC1Q2DUS, AC1Q2DUT, 3,4 dimethyl benzaldehyde, 3,4-di-methylbenzaldehyde, 3,4-Dimethyl benzaldehyde, EC 227-770-2, DSSTox_CID_21626, DSSTox_RID_79794, DSSTox_GSID_41626, SCHEMBL98097, KSC269I6L, AC1L2K35, ACMC-1B116, CHEMBL3187739, DTXSID2041626, 3,4-Dimethylbenzaldehyde, 98%, CTK1G9465, KS-00000NDS, POQJHLBMLVTHAU-UHFFFAOYSA-, DIMETHYLBENZALDEHYDE,3,4-, ACT00755, BCP24427, ZINC2146875, Tox21_301638, ANW-33331, RW2390, SBB063355, STL185667, AKOS009075842, AC-3245, AS05590, CM11941, LS11363, MCULE-4139700449, PS-4693, RP20144, TRA0011346, NCGC00255646-01, AC-15539, AJ-33615, AK-88497, AN-13134, CJ-07781, CJ-33022, SC-05614, SY004808, CAS-5973-71-7, AB1000228, DB-024155, RT-001870, ST2404599, D3334, FT-0614367, ST51038484, EN300-22064, Z-3864, MFCD00016612 (97+%), 973D717, A832442, I01-1391, Q-200344, InChI=1/C9H10O/c1-7-3-4-9(6-10)5-8(7)2/h3-6H,1-2H3, null, DMB-aldehyde, 3,4-dimethoxypyridine, Ambap4839, C9H10O, Aldehyde dimethyl-3,4-benzoique, C9-H10-O, CID22278, H192, 3,4-Dimethylbenzaldehyde, 99% - 25G 25g, C476925,

Complexity	120
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	134.073g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	134.178g/mol
Monoisotopic Mass	134.073g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number