AG004WTS

830-79-5 | 2,4,6-Trimethoxybenzaldehyde

AG004WTS

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CAS Number	830-79-5
Catalog Number	AG004WTS(AGN-PC-0JL9F4)
Chemical Name	2,4,6-Trimethoxybenzaldehyde
EC Number	212-598-2
IUPAC Name	2,4,6-trimethoxybenzaldehyde
InChI	InChI=1S/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3
InChI Key	CRBZVDLXAIFERF-UHFFFAOYSA-N
MDL Number	MFCD00003313
Molecular Formula	C10H12O4
Molecular Weight	196.1999
SMILES	C(=O)c1c(OC)cc(cc1OC)OC
Synonyms	2,4,6-Trimethoxybenzaldehyde, 830-79-5, Benzaldehyde, 2,4,6-trimethoxy-, BRN 1956051, EINECS 212-598-2, MFCD00003313, AI3-36672, CRBZVDLXAIFERF-UHFFFAOYSA-N, 2,4,6-Trimethoxybenzaldehyde, 98%, PubChem8264, ACMC-1CUHN, AC1L2D6K, AC1Q6Q1Q, SCHEMBL34873, KSC490M2H, 2,4,6-Trimethoxy-benzaldehyde, 2,4,6-trimethoxybenz aldehyde, 2,4,6-trimethoxybenz-aldehyde, AC1Q490D, CHEMBL2234486, 2,4,6-Trimethoxy benz aldehyde, CRBZVDLXAIFERF-UHFFFAOYSA-, CTK3J0623, KS-00000KRJ, ZINC32312, DTXSID70232119, 1-Formyl-2,4,6-trimethoxybenzene, ACT00450, ANW-37647, BBL027431, FC0747, SBB000351, STL373484, AKOS000120758, AS04586, CS-W009225, EBD2222741, LS11364, MCULE-6594436222, RL05153, RP25436, RTC-062114, TRA0090321, AC-12837, AJ-08543, AK-49060, AN-20524, AS-14420, BC205266, BR-49060, CJ-00177, L055, LS-25169, SC-06897, ST044473, SY015346, ZB000897, AB0007539, DB-019837, ST2415723, TC-062114, TL8005471, AM20050246, FT-0082909, FT-0633009, MFCD00003313 (98%), M-2304, 830T795, A840488, A840500, A842494, AB-131/40897219, W-104152, F0001-2130, InChI=1/C10H12O4/c1-12-7-4-9(13-2)8(6-11)10(5-7)14-3/h4-6H,1-3H3, ACN-S002048, C10H12O4, CID70019, AR-1D3102, C10-H12-O4, T2651, 4-08-00-02717 (Beilstein Handbook Reference), 2,4,6-Trimethoxybenzaldehyde, 98% - 25G 25g, 88-19-7, 83-01-2,

Complexity	169
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	196.074g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	196.202g/mol
Monoisotopic Mass	196.074g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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

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