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(S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE

(S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE structure

CAS No:
93470-27-0
Formula:
C9H15NO
Chemical Name:
(S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE
Synonyms:
(S)-(+)-1-CYCLOHEXYLETHYL ISOCYANATE;[(1S)-1-Isocyanatoethyl]cyclohexane;(S)-(+)-1-Cyclohexylethylisocyanate;SCHEMBL957438;CTK5H2560;(1S)-1-cyclohexylethanisocyanate;DTXSID60654280;(S)-1-Cyclohexylethyl isocyanate;(S)-(1-isocyanatoethyl)cyclohexane;ZINC2548054

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(S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE Basic Attributes

Molecular Weight：

153.22100

Exact Mass：

153.11500

DSSTox ID：

DTXSID60654280

HScode：

2929109000

Characteristics

PSA：

29.43000

XLogP3：

2.29100

Density：

1.02g/cm3

Boiling Point：

213.8ºC at 760mmHg

Flash Point：

80.5ºC

Refractive Index：

1.465

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

UN 2206

hazard class code：

R20/22;R36/37/38;R42

safety instructions：

S23-S26-S36/37/39-S45

Computed Properties

Molecular Weight:153.22
XLogP3:3.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:153.115364102
Monoisotopic Mass:153.115364102
Topological Polar Surface Area:29.4
Heavy Atom Count:11
Complexity:155
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE

Basic Attributes
Characteristics
Safety Information
Computed Properties

(S)-(+)-1-CYCLOHEXYLETHYLISOCYANATE

SDS

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