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2-(Dibutylamino)ethanethiol

HCID 79923
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Basic information

CAS
5842-08-0
Standard SMILES
CCCCN(CCS)CCCC
InChIKey
LOJUMTFVTNJLTF-UHFFFAOYSA-N
Molecular formula
C10H23NS
Average molar mass
189.36 g/mol
Monoisotopic mass
189.15512091

Names & identifiers

Preferred name
2-(Dibutylamino)ethanethiol
IUPAC
2-(dibutylamino)ethanethiol

Names & synonyms

2-(Dibutylamino)ethanethiolEthanethiol, 2-(dibutylamino)-5842-08-0DTXSID30207126RefChem:1061552DTXCID301296172-(dibutylamino)ethane-1-thiolBRN 0969334N-Di-n-butylcysteamin [German]N-Di-n-butylcysteaminSCHEMBL2466600SCHEMBL4976008
Show more names
SBB077061AKOS005136467

Database identifiers

CAS
5842-08-0
PubChem CID
79923
DTXSID
DTXSID30207126
Nikkaji
J49.732K

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
4.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
8
Heavy atoms
12
Formal charge
0
Complexity
77.9

Related reactions

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Compound notes

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