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N,N′-Dihexylthiourea

N,N′-Dihexylthiourea structure

CAS No:
21071-28-3
Formula:
C13H28N2S
Chemical Name:
N,N′-Dihexylthiourea
Synonyms:
Thiourea,N,N′-dihexyl-;Urea,1,3-dihexyl-2-thio-;N,N′-Dihexylthiourea;1,3-Dihexylthiourea;N,N-Di-n-hexylthiourea
Categories:
Chemical Reagents > Organic Reagents

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N,N′-Dihexylthiourea Basic Attributes

Molecular Weight：

244.44

Exact Mass：

244.44

EC Number：

244-191-0

DSSTox ID：

DTXSID10175298

HScode：

2930909090

Characteristics

PSA：

56.2

XLogP3：

4.39290

Density：

0.919g/cm3

Melting Point：

34-38 °C

Boiling Point：

322.1ºC at 760 mmHg

Flash Point：

148.6ºC

Refractive Index：

1.489

Safety Information

hazard class code：

safety instructions：

22-36/37

Precautionary statement(s)：

P264, P270, P273, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P273, P301+P312, P330, 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.

Computed Properties

Molecular Weight:244.44
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:10
Exact Mass:244.19732008
Monoisotopic Mass:244.19732008
Topological Polar Surface Area:56.2
Heavy Atom Count:16
Complexity:144
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes