2,6-Xylyl phosphate
CAS Registry Number®
121-06-2
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CAS Name
2,6-Xylyl phosphateMolecular Formula
C24H27O4PMolecular Mass
410.44Cite this Page
2,6-Xylyl phosphate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=121-06-2 (retrieved ) (CAS RN: 121-06-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
262-264 °C @ Press: 6 TorrMelting Point (1)
137.8 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C24H27O4P/c1-16-10-7-11-17(2)22(16)26-29(25,27-23-18(3)12-8-13-19(23)4)28-24-20(5)14-9-15-21(24)6/h7-15H,1-6H3
InChIKey
InChIKey=QLORRTLBSJTMSN-UHFFFAOYSA-N
SMILES
O(P(OC1=C(C)C=CC=C1C)(OC2=C(C)C=CC=C2C)=O)C3=C(C)C=CC=C3C
Canonical SMILES
O=P(OC=1C(=CC=CC1C)C)(OC=2C(=CC=CC2C)C)OC=3C(=CC=CC3C)C
Other Names for this Substance
- Phenol, 2,6-dimethyl-, phosphate (3:1)
- 2,6-Xylenol, phosphate (3:1)
- 2,6-Xylyl phosphate
- 2,6-Xylyl phosphate ((C8H9O)3PO)
- Tri-2,6-xylyl phosphate
