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2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE

2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE structure

CAS No:
149488-89-1
Formula:
C9H13NS
Chemical Name:
2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE
Synonyms:
1-(2-ISOTHIOCYANATO-ETHYL)-CYCLOHEXENE;2-CYCLOHEX-1-ENYLETHYL ISOTHIOCYANATE;2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE;2-(1-Cyclohexen-1-yl)ethylisothiocyanate, 95+%;1-[2-(Isothiocyanato)ethyl]cyclohex-1-ene 95+%;1-(2-isothiocyanatoethyl)cyclohex-1-ene

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2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE Basic Attributes

Molecular Weight：

167.27

Exact Mass：

167.07700

DSSTox ID：

DTXSID40370996

Characteristics

PSA：

44.4

XLogP3：

2.97970

Density：

1.03±0.1 g/cm3(Predicted)

Boiling Point：

101/0.3mm

Flash Point：

113.6ºC

Refractive Index：

1.552

Vapor Pressure：

0.0176mmHg at 25°C

Safety Information

Marks：

Hazard note：

Irritant

Computed Properties

Molecular Weight:167.27
XLogP3:3.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:167.07687059
Monoisotopic Mass:167.07687059
Topological Polar Surface Area:44.4
Heavy Atom Count:11
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-(1-CYCLOHEXEN-1-YL)ETHYLISOTHIOCYANATE

SDS

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