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21327-14-0

21327-14-0 Structure

21327-14-0 Structure
IdentificationBack Directory
[Name]

1-(3-BROMOPHENYL)-2-THIOUREA
[CAS]

21327-14-0
[Synonyms]

N-(3-BROMOPHENYL)THIOUREA
1-(3-bromophenyl)thiourea
1-(3-BROMOPHENYL)-2-THIOUREA
Thiourea, N-(3-bromophenyl)-
[Molecular Formula]

C7H7BrN2S
[MDL Number]

MFCD00060440
[MOL File]

21327-14-0.mol
[Molecular Weight]

231.11
Chemical PropertiesBack Directory
[Melting point ]

150 °C
[Boiling point ]

314.7±44.0 °C(Predicted)
[density ]

1.728±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C(protect from light)
[solubility ]

DMSO (Slightly), Methanol (Slightly)
[form ]

powder to crystal
[pka]

13.04±0.70(Predicted)
[color ]

White to Orange to Green
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301
[Precautionary statements ]

P264-P270-P301+P310+P330-P405-P501
[Risk Statements ]

36/37/38-43
[Safety Statements ]

26-36/37/39-36/37
[RIDADR ]

2811
[HS Code ]

2930.90.2900
[HazardClass ]

6.1
[PackingGroup ]

III
Questions And AnswerBack Directory
[Structure]

(3-Bromophenyl)thiourea, C7H7BrN2S, the thio­urea moiety is nearly planar (r.m.s. deviation = 0.004 Å) and it forms a dihedral angle of 66.72 (15)° with the benzene ring. The C—N—C—N2 torsion angle is 15.1 (4)°. In the crystal, mol­ecules are linked via N—H⋯S and N—H⋯N hydrogen bonds into sheets lying parallel to (101)[1].
1-(3-BROMOPHENYL)-2-THIOUREA
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