AG003B38

6175-45-7 | 2,2-Diethoxy-1-phenylethanone

AG003B38

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CAS Number	6175-45-7
Catalog Number	AG003B38(AGN-PC-0JKGJE)
Chemical Name	2,2-Diethoxy-1-phenylethanone
EC Number	228-220-4
IUPAC Name	2,2-diethoxy-1-phenylethanone
InChI	InChI=1S/C12H16O3/c1-3-14-12(15-4-2)11(13)10-8-6-5-7-9-10/h5-9,12H,3-4H2,1-2H3
InChI Key	PIZHFBODNLEQBL-UHFFFAOYSA-N
MDL Number	MFCD00009659
Molecular Formula	C12H16O3
Molecular Weight	208.2536
NSC Number	66180
SMILES	CCOC(OCC)C(=O)C1=CC=CC=C1
UNII	W4BCZ1MAK3
Synonyms	2,2-DEAP, 2,2-diethoxyacetophenone, 2,2-Diethoxyacetophenone, 6175-45-7, 2,2-Diethoxy-1-phenylethanone, Phenylglyoxal diethyl acetal, Ethanone, 2,2-diethoxy-1-phenyl-, 2,2-Diethoxy-1-phenylethan-1-one, alpha,alpha-Diethoxyacetophenone, UNII-W4BCZ1MAK3, 2,2-diethoxy acetophenone, CCRIS 5222, Benzoylformaldehyde Diethyl Acetal, GLYOXAL, PHENYL-, 2-(DIETHYL ACETAL), EINECS 228-220-4, MFCD00009659, NSC 66180, W4BCZ1MAK3, BRN 2100306, Phenylglyoxal 2-diethyl acetal, 2,2-diethoxy-1-phenyl-ethanone, PIZHFBODNLEQBL-UHFFFAOYSA-N, W-105103, 2,2-Diethoxyacetophenone, 96%, diethoxyacetophenone, a,a-diethoxyacetophenone, ACMC-209mvz, AC1L2KLT, 2,2-diethoxy-acetophenone, 2',2'-Diethoxyacetophenone, DSSTox_CID_30866, DSSTox_GSID_52294, SCHEMBL23238, 4-07-00-02130 (Beilstein Handbook Reference), KSC353G7H, Glyoxal, 2-(diethyl acetal), Ethanone,2-diethoxy-1-phenyl-, DTXSID1052294, CTK2F3373, PIZHFBODNLEQBL-UHFFFAOYSA-, 2,2-Diethoxyacetophenone, >95%, ZINC388477, BB_SC-07150, NSC66180, ZX-AT015500, Tox21_303796, .alpha.,.alpha.-Diethoxyacetophenone, ANW-33933, BBL011505, NSC-66180, SBB068691, STL146618, AKOS005721177, MCULE-9307737308, OR18102, RTR-021243, NCGC00357083-01, 64131-70-0, AJ-20644, AN-21194, AS-14401, BC678053, CC-06458, CJ-03265, LS-72987, SC-94895, ZB011539, CAS-6175-45-7, AX8064405, ST2415585, TR-021243, D1640, FT-0609220, ST51037213, A833405, C-10603, I14-8227, InChI=1/C12H16O3/c1-3-14-12(15-4-2)11(13)10-8-6-5-7-9-10/h5-9,12H,3-4H2,1-2H3, DEAP, C12H16O3, 2,2-Diethoxyacetophenone; DEAP, CID22555, ZINC00388477, C12-H16-O3, L007, 2,2-Diethoxyacetophenone, 97% - 100G 100g,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	208.11g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	208.257g/mol
Monoisotopic Mass	208.11g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H315-H319-H335-H351
Packing Group	Ⅲ
Precautionary statements	P261-P280-P305+P351+P338
Signal Words	danger
UN Code	UN 2811

Certificate of Analysis

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