AG00IC2Q

70547-87-4 | Benzaldehyde, 4-hydroxy-2,6-dimethyl-

AG00IC2Q

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CAS Number	70547-87-4
Catalog Number	AG00IC2Q(AGN-PC-0JTF2P)
Chemical Name	Benzaldehyde, 4-hydroxy-2,6-dimethyl-
IUPAC Name	4-hydroxy-2,6-dimethylbenzaldehyde
InChI	InChI=1S/C9H10O2/c1-6-3-8(11)4-7(2)9(6)5-10/h3-5,11H,1-2H3
InChI Key	XXTRGLCPRZQPHJ-UHFFFAOYSA-N
MDL Number	MFCD00016979
Molecular Formula	C9H10O2
Molecular Weight	150.1745
SMILES	O=CC1=C(C)C=C(O)C=C1C
Synonyms	2,6-Dimethyl-4-hydroxybenzaldehyde, 70547-87-4, 4-Hydroxy-2,6-dimethylbenzaldehyde, 2,6-Dimethyl-4-hydrobenzaldehyde, 2,6-dimethyl-4-hydroxy benzaldehyde, 4-hydroxy-2,6-dimethyl-benzaldehyde, Benzaldehyde, 4-hydroxy-2,6-dimethyl-, XXTRGLCPRZQPHJ-UHFFFAOYSA-N, PubChem3148, AC1LBY9L, ACMC-209of4, KSC377C5L, 3,5-Dimethyl-4-formylphenol, SCHEMBL516188, CTK2H7155, KS-00000JMX, DTXSID50343631, SYNQUEST 2715-1-Y6, 2.6-Dimethyl-4-hydroxybenzaldehyde, ACT01019, BCP22393, ZINC2566090, 2,6-dimethyl-4-hydroxy-benzaldehyde, 2.6-dimethyl-4-hydroxy-benzaldehyde, ANW-35918, CD-391, MFCD00016979, SBB008519, 4-Hydroxy-2,6-dimethylbenzaldehyde #, AKOS005145852, AC-1194, ACN-038504, ACN-048817, AS05592, AT-8100, CM11943, CS-W005005, DK-0706, FR-2208, LS10368, MCULE-4197408041, RTC-060747, VZ22975, 1,3-Dimethyl-2-formyl-5-hydroxybenzene, AJ-41225, AK-36167, AN-15151, BC201444, BP-11091, BR-36167, CJ-09736, SC-06432, SY017072, AB0008705, DB-012658, TC-060747, TL8004977, 4CH-011188, A9302, AM20041052, C2687, FT-0084540, FT-0610691, FT-0654331, ST24023557, ST50824217, DIMETHYL(2,6-)-4-HYDROXYBENZALDEHYDE, MFCD00016979 (95%), 2,6-dimethyl-4-hydroxybenzaldehyde, AldrichCPR, A-2055, I01-0025, Q-102470, Q-200486, InChI=1/C9H10O2/c1-6-3-8(11)4-7(2)9(6)5-10/h3-5,11H,1-2H, 4-Hydroxyphenylpropionic acid, C9H10O2, CID591072,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.068g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.177g/mol
Monoisotopic Mass	150.068g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number