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1-(3-CARBOXYPHENYL)-2-THIOUREA

1-(3-CARBOXYPHENYL)-2-THIOUREA structure

CAS No:
37182-75-5
Formula:
C8H8N2O2S
Chemical Name:
1-(3-CARBOXYPHENYL)-2-THIOUREA
Synonyms:
1-(3-CARBOXYPHENYL)-2-THIOUREA;3-[(AMINOCARBOTHIOYL)AMINO]BENZOIC ACID;3-[(AMINOCARBONOTHIOYL)AMINO]BENZOIC ACID;RARECHEM AL BO 0602;1-(3-Carboxyphenyl)-2-thiourea 96%
Categories:
Chemical Reagents > Organic Reagents

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1-(3-CARBOXYPHENYL)-2-THIOUREA Basic Attributes

Molecular Weight：

196.23

Exact Mass：

196.03100

DSSTox ID：

DTXSID20356218

HScode：

2930909090

Characteristics

PSA：

107

XLogP3：

1.81360

Density：

1.508 g/cm3

Melting Point：

187-191 °C(lit.)

Boiling Point：

399.8ºC at 760 mmHg

Flash Point：

195.6ºC

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:196.23
XLogP3:1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:196.03064868
Monoisotopic Mass:196.03064868
Topological Polar Surface Area:107
Heavy Atom Count:13
Complexity:220
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3-CARBOXYPHENYL)-2-THIOUREA

Basic Attributes
Characteristics
Safety Information
Computed Properties
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1-(3-CARBOXYPHENYL)-2-THIOUREA

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