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Reference substances

Reference substances

Currently viewing:
IUPAC name:
Dodecanoic acid, ester with 1,2,3-propanetriol

Inventory

CAS number:
37318-95-9

Synonyms

Molecular and structural information

Molecular formula:
C12 mono: C15H30O4
C12 di: C27H52O5
C12 tri: C39H74O6
Molecular weight:
> 274.4 - < 639
SMILES notation:
OCC(O)COC(=O)CCCCCCCCCCC;
O=C(CCCCCCCCCCC)OCC(O)COC(=O)CCCCCCCCCCC;
O=C(CCCCCCCCCCC)OC(COC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCC
InChl:
InChI=1S/C15H30O4/c1-2-3-4-5-6-7-8-9-10-11-15(18)19-13-14(17)12-16/h14,16-17H,2-13H2,1H3;
InChI=1S/C27H52O5/c1-3-5-7-9-11-13-15-17-19-21-26(29)31-23-25(28)24-32-27(30)22-20-18-16-14-12-10-8-6-4-2/h25,28H,3-24H2,1-2H3;
InChI=1S/C39H74O6/c1-4-7-10-13-16-19-22-25-28-31-37(40)43-34-36(45-39(42)33-30-27-24-21-18-15-12-9-6-3)35-44-38(41)32-29-26-23-20-17-14-11-8-5-2/h36H,4-35H2,1-3H3
Structural formula:
Chemical structure

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