2-(benzylthio)-ethylamine
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2-(benzylthio)-ethylamine
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CAS No:
1007-54-1
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Formula:
C9H13NS
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Chemical Name:
2-(benzylthio)-ethylamine
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Synonyms:
2-(benzylthio)ethylamine; 2-(3-CHLOROPROPYL)-3-(4-METHOXYPHENYL)-1-OXO-1,2,3,4-TETRAHYDRO-4-ISOQUINOLINECARBOXYLIC ACID; 2-benzylsulfanyl-ethylamine; 2-benzylmercaptoethylamine; 2-(benzylthio)-1-aminoethane hydrochloride;
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CAS No:
Safety Information
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:167.27
XLogP3:1.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:167.07687059
Monoisotopic Mass:167.07687059
Topological Polar Surface Area:51.3
Heavy Atom Count:11
Complexity:89.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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