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Details

Stereochemistry ACHIRAL
Molecular Formula C19H6F35O4P
Molecular Weight 994.1664
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,18,18,18-Dotriacontafluoro-17-(trifluoromethyl)octadecyl dihydrogen phosphate

SMILES

OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)F

InChI

InChIKey=VHQPVCVRRDZXSW-UHFFFAOYSA-N
InChI=1S/C19H6F35O4P/c20-3(21,1-2-58-59(55,56)57)5(23,24)7(27,28)9(31,32)11(35,36)13(39,40)15(43,44)17(47,48)16(45,46)14(41,42)12(37,38)10(33,34)8(29,30)6(25,26)4(22,18(49,50)51)19(52,53)54/h1-2H2,(H2,55,56,57)

HIDE SMILES / InChI

Molecular Formula C19H6F35O4P
Molecular Weight 994.1664
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:25:36 GMT 2023
Edited
by admin
on Sat Dec 16 12:25:36 GMT 2023
Record UNII
HA752A46RG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,18,18,18-Dotriacontafluoro-17-(trifluoromethyl)octadecyl dihydrogen phosphate
Common Name English
1-Octadecanol, 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,18,18,18-dotriacontafluoro-17-(trifluoromethyl)-, dihydrogen phosphate
Systematic Name English
Code System Code Type Description
PUBCHEM
16206073
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
CAS
94231-59-1
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID30241126
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
FDA UNII
HA752A46RG
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
303-878-6
Created by admin on Sat Dec 16 12:25:36 GMT 2023 , Edited by admin on Sat Dec 16 12:25:36 GMT 2023
PRIMARY