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1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- structure

CAS No:
92444-14-9
Formula:
C19H27NS
Chemical Name:
1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-
Synonyms:
6CPS;1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-;1-(4-hexyl-cyclohexyl)-4-isothiocyanato-benzene;1-(trans-4-hexylcyclohexyl)-4-isothio-cyanatobenz

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1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO- Basic Attributes

Molecular Weight：

301.48900

Exact Mass：

301.18600

DSSTox ID：

DTXSID90392603

HScode：

2930909090

Characteristics

PSA：

44.45000

XLogP3：

6.66510

Density：

0.977 g/mL at 25ºC(lit.)

Melting Point：

12.6 °C

Boiling Point：

418.5ºC at 760 mmHg

Flash Point：

113ºC

Refractive Index：

n20/D 1.532(lit.)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

20/21/22-36/37/38

safety instructions：

23-26-28-36

Marks：

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H312-H315-H319-H332-H335

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1-(4-hexylcyclohexyl)-4-isothiocyanatobenzene

Computed Properties

Molecular Weight:301.5
XLogP3:8.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:301.18642104
Monoisotopic Mass:301.18642104
Topological Polar Surface Area:44.4
Heavy Atom Count:21
Complexity:319
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: e1390; dipotassium; polyacrylic acid; h2cro4; sodium sulfite formula; nf3 compound name

Guide of 1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

1-(TRANS-4-HEXYLCYCLOHEXYL)-4-ISOTHIO-

SDS

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