AG003APA

16368-97-1 | Bis(2-ethylhexyl) phenyl phosphate

AG003APA

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CAS Number	16368-97-1
Catalog Number	AG003APA(AGN-PC-0JLVZS)
Chemical Name	Bis(2-ethylhexyl) phenyl phosphate
EC Number	240-424-5
IUPAC Name	bis(2-ethylhexyl) phenyl phosphate
InChI	InChI=1S/C22H39O4P/c1-5-9-14-20(7-3)18-24-27(23,26-22-16-12-11-13-17-22)25-19-21(8-4)15-10-6-2/h11-13,16-17,20-21H,5-10,14-15,18-19H2,1-4H3
InChI Key	ZXZYMQCBRZBVIC-UHFFFAOYSA-N
MDL Number	MFCD28252177
Molecular Formula	C22H39O4P
Molecular Weight	398.5164
SMILES	P(=O)(OCC(CCCC)CC)(OCC(CCCC)CC)OC1=CC=CC=C1
Synonyms	Bis(2-ethylhexyl) phenyl phosphate, DAFF, DEPP, Phosphoric acid, bis(2-ethylhexyl) phenyl ester, 16368-97-1, Di(2-ethylhexyl)phenyl phosphate, Bis(2-ethylhexyl)phenyl phosphate, EINECS 240-424-5, BRN 2012463, AI3-16977, Phosphoric acid, bis(2-ethylhexyl)phenyl ester, AC1L3ANQ, 4-06-00-00712 (Beilstein Handbook Reference), SCHEMBL124717, DTXSID6051770, bis-(2-ethylhexyl)-phenyl phosphate, AN-17446, LS-107477, Phosphoric acid bis(2-ethylhexyl)phenyl ester, C22H39O4P, CID85990, C22-H39-O4-P,

Complexity	372
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	398.259g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	398.524g/mol
Monoisotopic Mass	398.259g/mol
Rotatable Bond Count	16
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	7.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H410
Packing Group	Ⅲ
Precautionary statements	P273-P391-P501
UN Code	UN 3077

Certificate of Analysis

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