20098-16-2
1,4-ADAMANTANDIOL
Name
1,4-ADAMANTANDIOL
Formula
C10 H16 O2
MolWeight
168.234
1Identification
【Name】
1,4-ADAMANTANDIOL
【CAS】
【MDL】
MFCD00181051
【English Synonyms】
【Formula】
C10 H16 O2
【MolWeight】
168.234
【Inchi】
InChI=1S/C10H16O2/c11-9-7-1-6-2-8(9)5-10(12,3-6)4-7/h6-9,11-12H,1-5H2/t6-,7-,8+,9?,10-
【InChIKey】
InChIKey=AUKWRHADVIQZRJ-GQDYVDLUSA-N
【SMILES】
C1[C@@H]2C[C@H]3C[C@@](C2)(C[C@@H]1C3O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:2
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1,4-ADAMANTANDIOL.cml
Quick Release
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