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1-?????????

1-?????????
1-????????? ??? ???
?? ??:
78-27-3
???:
1-?????????
???(??):
1-?????????;1-???-1-??????
???:
1-Ethynyl-1-cyclohexanol
???(??):
1-ETHYNYLCYCLOHEXANOL;1-Ethynylcyclohexan-1-ol;Cyclohexanol, 1-ethynyl-;Ethynylcyclohexanol;1-ETHINYL-1-CYCLOHEXANOL;nsc8194;-1-cycL;ohexanoL;1-EthynyL;HC≡CC6H10OH
CBNumber:
CB2186195
???:
C8H12O
??? ??:
124.18
MOL ??:
78-27-3.mol
MSDS ??:
SDS

1-????????? ??

???
30-33 °C(lit.)
?? ?
180 °C(lit.)
??
0.967 g/mL at 25 °C(lit.)
???
<1 mm Hg ( 20 °C)
???
1.481-1.484
???
163 °F
?? ??
Store below +30°C.
???
10g/L(20°C)
??? ??
?? ?? ??
?? ?? (pKa)
13.34±0.20(Predicted)
??
????~???
??????(pH)
7 (1g/l, H2O, 20℃)
????
1.3-8.7%(V)
???
10g/L(20℃)
BRN
471404
InChI
1S/C8H12O/c1-2-8(9)6-4-3-5-7-8/h1,9H,3-7H2
InChIKey
QYLFHLNFIHBCPR-UHFFFAOYSA-N
SMILES
OC1(CCCCC1)C#C
LogP
1.49 at 25℃
CAS ??????
78-27-3(CAS DataBase Reference)
NIST
Cyclohexanol, 1-ethynyl-(78-27-3)
EPA
Cyclohexanol, 1-ethynyl- (78-27-3)
??
  • ?? ? ?? ??
  • ?? ? ???? ?? (GHS)
??? ?? Xn,Xi
?? ???? ?? 21/22-36-36/37/38-20/21/22-36/38
????? 36/37-36/37/39-26-36-22
????(UN No.) UN 2811 6.1/PG 3
WGK ?? 1
RTECS ?? GV9100000
?? ?? ?? 365 °C
TSCA TSCA listed
?? ?? 6.1
???? III
HS ?? 29061900
???? ??? 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
?? LD50 orally in Rabbit: 583 mg/kg LD50 dermal Rabbit 973 mg/kg
???? ?? KE-14086
????(GHS): Skull and Crossbones (GHS06)
?? ?: Danger
??·?? ??:
?? ??·?? ?? ?? ?? ?? ?? ? ?? ?? P- ??
H302 ??? ??? ?? ?? ?? - ?? ?? 4 ?? P264, P270, P301+P312, P330, P501
H311 ??? ???? ??? ?? ?? ?? - ?? ?? 3 ?? P280, P302+P352, P312, P322, P361,P363, P405, P501
H315 ??? ??? ??? ????? ?? ????? ?? 2 ?? P264, P280, P302+P352, P321,P332+P313, P362
H319 ?? ?? ??? ??? ?? ? ?? ?? ??? ?? ?? 2A ?? P264, P280, P305+P351+P338,P337+P313P
??????:
P264 ?? ??? ?? ??? ????.
P264 ?? ??? ?? ??? ????.
P270 ? ??? ??? ??? ???, ???? ???? ???.
P280 ????/???/???/?????? ?????.
P301+P312 ??? ???? ??? ????(??)? ??? ????.
P305+P351+P338 ?? ??? ? ?? ?? ???? ????. ???? ?????? ?????. ?? ????.
NFPA 704
2
2 0

1-????????? MSDS


1-Ethynylcyclohexanol

1-????????? C??? ??, ??, ??

??? ??

Colorless liquid

??

1-Ethynyl-1-cyclohexanol (ECHO) can undergo acetylation in the presence of a catalytic amount of ruthenium chloride at room temperature. It can be used to synthesize novel organotellurium(IV) compounds with potent inhibitory activity towards Cathepsin B. The polymerization of ECHO by transition metal catalysts leads to the formation of poly(ECHO). It can also react with transition metal hydride complexes to form vinyl derivatives by inserting into the M-H bonds.

Synthesis Reference(s)

Organic Syntheses, Coll. Vol. 3, p. 416, 1955
Synthetic Communications, 18, p. 131, 1988 DOI: 10.1080/00397918808077336

1-????????? ?? ?? ? ???

???

?? ??


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