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N,N-Diphenylthiourea

N,N-Diphenylthiourea structure

CAS No:
3898-08-6
Formula:
C13H12N2S
Chemical Name:
N,N-Diphenylthiourea
Synonyms:
Thiourea,N,N-diphenyl-;Urea,1,1-diphenyl-2-thio-;N,N-Diphenylthiourea;1,1-Diphenyl-2-thiourea;1,1-Diphenylthiourea;NSC 49187
Categories:
Chemical Reagents > Organic Reagents

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N,N-Diphenylthiourea Basic Attributes

Molecular Weight：

228.31

Exact Mass：

228.31

EC Number：

223-448-0

UNII：

MPJ2UNH7EF

NSC Number：

49187

DSSTox ID：

DTXSID6063228

HScode：

2930909090

Characteristics

PSA：

61.4

XLogP3：

3.41

Density：

1.1±0.1 g/cm3

Melting Point：

212 °C

Boiling Point：

325.5±25.0 °C at 760 mmHg

Flash Point：

150.6±23.2 °C

Refractive Index：

1.619

Water Solubility：

>34.2 [ug/mL]

Safety Information

RTECS Number：

YT2100000

N,N-Diphenylthiourea Use and Manufacturing

Manufacturing Info：

Thiourea, N,N-diphenyl-: ACTIVE

Computed Properties

Molecular Weight:228.31
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:228.07211956
Monoisotopic Mass:228.07211956
Topological Polar Surface Area:61.4
Heavy Atom Count:16
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes