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Structure

Dipropyl sulfate

CAS
598-03-8
Catalog Number
ACM598038
Category
Other Products
Molecular Weight
150.24g/mol
Molecular Formula
C6H14O2S

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Specification

IUPAC Name
1-propylsulfonylpropane
Canonical SMILES
CCCS(=O)(=O)CCC
InChI
InChI=1S/C6H14O2S/c1-3-5-9(7,8)6-4-2/h3-6H2,1-2H3
InChI Key
JEXYCADTAFPULN-UHFFFAOYSA-N
Boiling Point
270.0 °C
Melting Point
29.5 °C
Complexity
129
Covalently-Bonded Unit Count
1
EC Number
209-913-0
Exact Mass
150.071451g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
0
Heavy Atom Count
9
LogP
0.39 (LogP)
Monoisotopic Mass
150.071451g/mol
NSC Number
4865
Rotatable Bond Count
4
UNII
581DRO3V26
Vapor Pressure
0.00 mmHg
XLogP3
1.4
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