83150-77-0
(1S)-3-CYCLOHEXENE-1-METHANETHIOL,A,A,4-TRIMETHYL-
Name(1S)-3-CYCLOHEXENE-1-METHANETHIOL,A,A,4-TRIMETHYL-
1Identification
【Name】
(1S)-3-CYCLOHEXENE-1-METHANETHIOL,A,A,4-TRIMETHYL-
【CAS】
【MDL】
MFCD21608088
【English Synonyms】
【Formula】
C10 H18 S
【MolWeight】
170.318
【Inchi】
InChI=1S/C10H18S/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1
【InChIKey】
InChIKey=ZQPCOAKGRYBBMR-SECBINFHSA-N
【SMILES】
CC1=CC[C@H](CC1)C(C)(C)S
【MOL File】
(1S)-3-CYCLOHEXENE-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(1S)-3-CYCLOHEXENE-1-METHANETHIOL,A,A,4-TRIMETHYL-.cml