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139419-37-7 | 2-Propanol, 1-(2-ethoxyethoxy)-3-mercapto-
CAS No: 139419-37-7 Catalog No: AG001AZX MDL No:
Product Description
Catalog Number:
AG001AZX
Chemical Name:
2-Propanol, 1-(2-ethoxyethoxy)-3-mercapto-
CAS Number:
139419-37-7
Molecular Formula:
C7H16O3S
Molecular Weight:
180.2651
IUPAC Name:
1-(2-ethoxyethoxy)-3-sulfanylpropan-2-ol
InChI:
InChI=1S/C7H16O3S/c1-2-9-3-4-10-5-7(8)6-11/h7-8,11H,2-6H2,1H3
InChI Key:
IUQMNYJMEZLBFW-UHFFFAOYSA-N
SMILES:
CCOCCOCC(CS)O
Properties
Complexity:
80.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.082g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
180.262g/mol
Monoisotopic Mass:
180.082g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
39.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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