93257-31-9
3-HYDROXY-4,7,7-TRIMETHYL-BICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID
Name3-HYDROXY-4,7,7-TRIMETHYL-BICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID
1Identification
【Name】
3-HYDROXY-4,7,7-TRIMETHYL-BICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD06799424
【English Synonyms】
【Formula】
C11 H18 O3
【MolWeight】
198.26
【Inchi】
InChI=1S/C11H18O3/c1-9(2)10(3)4-5-11(9,8(13)14)6-7(10)12/h7,12H,4-6H2,1-3H3,(H,13,14)/t7?,10-,11+/m1/s1
【InChIKey】
InChIKey=XGYBHRIFVITMPY-RFSDDRETSA-N
【SMILES】
CC1([C@@]2(CC[C@]1(CC2O)C(=O)O)C)C
【MOL File】
3-HYDROXY-4,7,7-TRIM….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-HYDROXY-4,7,7-TRIMETHYL-BICYCLO[2.2.1]HEPTANE-1-CARBOXYLIC ACID.cml