1-Benzyl-3-methyl-2-thiourea
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1-Benzyl-3-methyl-2-thiourea
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CAS No:
2740-94-5
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Formula:
C9H12N2S
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Chemical Name:
1-Benzyl-3-methyl-2-thiourea
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Synonyms:
Thiourea,N-methyl-N′-(phenylmethyl)-;Urea,1-benzyl-3-methyl-2-thio-;N-Methyl-N′-(phenylmethyl)thiourea;1-Benzyl-3-methylthiourea;N-Benzyl-N′-methylthiourea;1-Benzyl-3-methyl-2-thiourea;N-Methyl-N′-benzylthiourea;1-Methyl-3-benzyl thiourea
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CAS No:
Characteristics
56.2
2.06230
solid
1.117 g/cm3
74-76 °C
281.7ºC at 760 mmHg
124.2ºC
1.596
0.00351mmHg at 25°C
Safety Information
UN3335
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:180.27
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:180.07211956
Monoisotopic Mass:180.07211956
Topological Polar Surface Area:56.2
Heavy Atom Count:12
Complexity:142
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes