AG001WMF

1663-61-2 | Benzene, (triethoxymethyl)-

AG001WMF

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CAS Number	1663-61-2
Catalog Number	AG001WMF(AGN-PC-0JLBI9)
Chemical Name	Benzene, (triethoxymethyl)-
EC Number	216-771-3
IUPAC Name	triethoxymethylbenzene
InChI	InChI=1S/C13H20O3/c1-4-14-13(15-5-2,16-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3
InChI Key	BQFPCTXLBRVFJL-UHFFFAOYSA-N
MDL Number	MFCD00009222
Molecular Formula	C13H20O3
Molecular Weight	224.2961
SMILES	C(C)OC(OCC)(OCC)C1=CC=CC=C1
Synonyms	(Triethoxymethyl)benzene, Triethyl orthobenzoate, 1663-61-2, Ethyl orthobenzoate, Benzene, (triethoxymethyl)-, triethoxymethylbenzene, Triethylorthobenzoate, Orthobenzoic acid, triethyl ester, Benzene,(triethoxymethyl)-, Orthobenzoic Acid Triethyl Ester, BQFPCTXLBRVFJL-UHFFFAOYSA-N, Triethyl orthobenzoate, 97%, (triethoxymethyl)benzol, EINECS 216-771-3, triethoxyphenylmethane, (triethoxymethyl)-benzen, AI3-11563, (Triethoxymethyl)benzene #, AC1L2LK1, AC1Q58JX, triethyl orthobenzoate 97%, KSC532G1P, SCHEMBL379267, AC1Q35G3, DTXSID7061859, BQFPCTXLBRVFJL-UHFFFAOYSA-, CTK4D2317, KS-00000BCL, alpha,alpha,alpha-Triethoxytoluene, ZINC391829, ACN-S004110, BCP20071, phenylorthoformic acid triethyl ester, MFCD00009222, AKOS009157729, CS-W002050, MCULE-9768657839, RL02138, AJ-21126, AK110846, AN-49635, AS-20045, SC-23075, SY003629, Triethyl orthobenzoate, >=95.0% (GC), ZB012066, ST2408382, TC-069958, TL8001277, FT-0633743, Z4262, EN300-60585, M-8557, MFCD00009222 (95+%), I14-5884, J-010274, J-525073, Z1258578240, InChI=1/C13H20O3/c1-4-14-13(15-5-2,16-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3, ortho-Benzoesauretriethylester, C13H20O3, KST-1A1947, CID74268, AR-1A7913, ZINC00391829, C13-H20-O3, Triethyl orthobenzoate, 95% - 25G 25g, T3070, 16951-32-9,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.141g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.3g/mol
Monoisotopic Mass	224.141g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	27.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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