AG000LL3

1241-94-7 | PHOSPHORIC ACID, 2-ETHYLHEXYL DIPHENYL ESTER

AG000LL3

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CAS Number	1241-94-7
Catalog Number	AG000LL3(AGN-PC-0JKBWM)
Chemical Name	PHOSPHORIC ACID, 2-ETHYLHEXYL DIPHENYL ESTER
EC Number	214-987-2
IUPAC Name	2-ethylhexyl diphenyl phosphate
InChI	InChI=1S/C20H27O4P/c1-3-5-12-18(4-2)17-22-25(21,23-19-13-8-6-9-14-19)24-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3
InChI Key	CGSLYBDCEGBZCG-UHFFFAOYSA-N
MDL Number	MFCD00059949
Molecular Formula	C20H27O4P
Molecular Weight	362.3997
SMILES	O=P(OC1=CC=CC=C1)(OCC(CC)CCCC)OC2=CC=CC=C2
UN Number	3082
Synonyms	2-ethylhexyldiphenylphosphate, di(2-ethylhexyl)phenylphosphate, 2-Ethylhexyl diphenyl phosphate, 1241-94-7, Octicizer, Phosphoric acid, 2-ethylhexyl diphenyl ester, Santicizer 141, Octicizer [USAN], (2-Ethylhexyl)-difenylfosfat, Diphenyl 2-ethylhexyl phosphate, Phosphoric acid diphenyl 2-ethylhexyl ester, 2-Ethylhexyldiphenylphosphate, 2-Ethylhexyl diphenylphosphate, DIPHENYL-2-ETHYLHEXYL PHOSPHATE, CCRIS 6199, HSDB 370, 1-Hexanol, 2-ethyl-, ester with diphenyl phosphate, Phosphoric Acid 2-Ethylhexyl Diphenyl Ester, EINECS 214-987-2, (2-Ethylhexyl)-difenylfosfat [Czech], BRN 2568983, AI3-16360, Ethylhexyl diphenyl phosphate, 2-, Octicizer (USAN), Phosphoric Acid Octyl Diphenyl Ester, Phosphoric aciddiphenyl ethylhexyl ester, W-108410, Phosflex 362, ACMC-1BZ8M, DSSTox_CID_5300, EC 214-987-2, AC1L24ER, DSSTox_RID_77735, DSSTox_GSID_25300, SCHEMBL93483, 4-06-00-00718 (Beilstein Handbook Reference), KSC490A5J, Jsp001610, CHEMBL2105213, DTXSID1025300, C20H27O4P, CGSLYBDCEGBZCG-UHFFFAOYSA-, CTK3J0054, CGSLYBDCEGBZCG-UHFFFAOYSA-N, Tox21_303313, ANW-18195, LS-699, MFCD00059949, AKOS015889797, RTR-003755, TRA0057322, KS-00000Z15, NCGC00257002-01, AK139988, AN-22367, AS-15838, BC200986, DA-16836, CAS-1241-94-7, 2-Ethylhexyl diphenyl ester phosphoric acid, 2-Ethylhexyl diphenyl phosphate (technical), AX8017849, TR-003755, FT-0645669, P1021, 2-Ethylhexyl diphenyl ester of phosphoric acid, D05224, 2-Ethyl-1-hexanol ester with diphenyl phosphate, A805209, C-44651, I01-3084, 2-Ethylhexyl diphenyl phosphate, PESTANAL(R), analytical standard, InChI=1/C20H27O4P/c1-3-5-12-18(4-2)17-22-25(21,23-19-13-8-6-9-14-19)24-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3, Disflamoll DPO, EHDP, Octyl diphenyl phosphate, UNII-4F53Z6NE1Y, ethylhexyl diphenyl phosphate, 4F53Z6NE1Y, di(2-ethylhexyl)phenylphosphate, CID14716, C20-H27-O4-P, R037, DIPHENYL, 2-ETHYLHEXYL-, PHOSPHATE, C018535,

Complexity	365
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	362.165g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	362.406g/mol
Monoisotopic Mass	362.165g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	6.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H301-H410
Packing Group	Ⅲ
Precautionary statements	P273-P301+P310-P305+P351+P338
UN Code	UN 3082

Certificate of Analysis

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