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114811-33-5 | Ethane, 1-[(2-chloroethyl)thio]-2-ethoxy-
CAS No: 114811-33-5 Catalog No: AG000FAN MDL No:
Product Description
Catalog Number:
AG000FAN
Chemical Name:
Ethane, 1-[(2-chloroethyl)thio]-2-ethoxy-
CAS Number:
114811-33-5
Molecular Formula:
C6H13ClOS
Molecular Weight:
168.6848
IUPAC Name:
1-(2-chloroethylsulfanyl)-2-ethoxyethane
InChI:
InChI=1S/C6H13ClOS/c1-2-8-4-6-9-5-3-7/h2-6H2,1H3
InChI Key:
UXYAOPOYEMOOHI-UHFFFAOYSA-N
SMILES:
ClCCSCCOCC
Properties
Complexity:
52.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.038g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.679g/mol
Monoisotopic Mass:
168.038g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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