AG003BEL

4316-35-2 | (1,1-Dimethoxyethyl)benzene

AG003BEL

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CAS Number	4316-35-2
Catalog Number	AG003BEL(AGN-PC-0JLR2T)
Chemical Name	(1,1-Dimethoxyethyl)benzene
EC Number	224-334-3
IUPAC Name	1,1-dimethoxyethylbenzene
InChI	InChI=1S/C10H14O2/c1-10(11-2,12-3)9-7-5-4-6-8-9/h4-8H,1-3H3
InChI Key	XKSUVRWJZCEYQQ-UHFFFAOYSA-N
MDL Number	MFCD00075617
Molecular Formula	C10H14O2
Molecular Weight	166.2170
SMILES	COC(C)(OC)C1=CC=CC=C1
Synonyms	(1,1-Dimethoxyethyl)benzene, Acetophenone dimethyl acetal, 4316-35-2, Benzene, (1,1-dimethoxyethyl)-, MFCD00075617, dimethoxyphenylethane, EINECS 224-334-3, ACMC-20aprm, AC1L2UAB, 1,1-dimethoxyethylbenzene, acetophenone dimethyl ketal, AC1Q55VS, Acetophenone, dimethyl acetal, SCHEMBL204375, Benzene,(1,1-dimethoxyethyl)-, DTXSID9063407, CTK4I7119, XKSUVRWJZCEYQQ-UHFFFAOYSA-N, ZINC389844, (1,1-Dimethoxyethyl)benzene, 97%, AKOS015889212, ACM4316352, FCH1114436, SC-97393, ZB011901, TC-173065, FT-0735647, C-54592, KST-1A4926, C10H14O2, CID78008, AR-1A0281, C10-H14-O2, 469-02-3,

Complexity	124
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	166.099g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	166.22g/mol
Monoisotopic Mass	166.099g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	18.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227
Packing Group
Precautionary statements	P210e-P280a-P370+P378a-P403+P235-P501a
UN Code	\N

Certificate of Analysis

Lot Number