CAS: 75-33-2
名称: propane-2-thiol
SMILES:
CC(C)SMolecular Processing
Molecular formula
C3H8S
Molecular weight
76.16
Exact mass
76.0347
XLogP
1.32
TPSA
0
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
4
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
1
Molar refractivity
24.12
Supplementary Information
InChIKey: KJRCEJOSASVSRA-UHFFFAOYSA-N
同義語
2-PropanethiolPropane-2-thiolISOPROPYL MERCAPTAN2-PropylthiolPropanethiol-(2)iso-C3H7SHHSDB 625DTXSID10254812mercaptopropaneUNII-E52LR62ETCEINECS 200-861-4E52LR62ETCAI3-22988NSC-87537CHEBI:8474DTXCID105481FEMA NO. 3897EC 200-861-4ISOPROPYL MERCAPTAN [HSDB]2propanethioli-propylthiol2Propylmercaptan1MethylethanethiolUN2402RefChem:891432-PROPYL MERCAPTANInChI=1/C3H8S/c1-3(2)4/h3-4H,1-2HKJRCEJOSASVSRA-UHFFFAOYSA-N75-33-2Isopropanethiol
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