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2-PHENYLETHYLTHIOUREA

2-PHENYLETHYLTHIOUREA structure

CAS No:
6815-00-5
Formula:
C9H12N2S
Chemical Name:
2-PHENYLETHYLTHIOUREA
Synonyms:
PHENETHYL-THIOUREA;N-PHENETHYLTHIOUREA;2-PHENYLETHYLTHIOUREA;1-(B-PHENETHYL)-2-THIOUREA;1-(BETA-PHENETHYL)-2-THIOUREA;(2-Phenylethyl)thiourea,97%;1-(Phenethyl)thiourea;1-Phenethylthiourea
Categories:
Chemical Reagents > Organic Reagents

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2-PHENYLETHYLTHIOUREA Basic Attributes

Molecular Weight：

180.27

Exact Mass：

180.07200

BRN：

2092343

Characteristics

PSA：

70.14000

XLogP3：

2.15350

Density：

1.153g/cm3

Melting Point：

150 °C

Boiling Point：

317.1ºC at 760 mmHg

Flash Point：

145.5ºC

Refractive Index：

1.619

Safety Information

Packing level：

III

Hazard category：

6.1

Transport codes：

2811

hazard class code：

20/21/22-36/37/38

safety instructions：

22-26-36/37/39

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 6 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:180.27
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:180.07211956
Monoisotopic Mass:180.07211956
Topological Polar Surface Area:70.1
Heavy Atom Count:12
Complexity:142
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes