127-27-5
PIMARIC ACID
Name
PIMARIC ACID
Formula
C18 H28 O2
MolWeight
276.417
1Identification
【Name】
PIMARIC ACID
【CAS】
【MDL】
MFCD01632486
【English Synonyms】
【Formula】
C18 H28 O2
【MolWeight】
276.417
【Inchi】
InChI=1S/C18H28O2/c1-12-5-7-14-13(11-12)6-8-15-17(14,2)9-4-10-18(15,3)16(19)20/h11-12,14-15H,4-10H2,1-3H3,(H,19,20)/t12-,14+,15-,17-,18-/m1/s1
【InChIKey】
InChIKey=AQMKARDJTJSPIX-BPSIQINWSA-N
【SMILES】
C[C@@H]1CC[C@H]2C(=C1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)C(=O)O)C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PIMARIC ACID.cml
Quick Release
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