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88318-15-4

88318-15-4 | Benzenethiol, 4-(2-ethoxyethoxy)-

CAS No: 88318-15-4 Catalog No: AG0047XS MDL No:

Product Description

Catalog Number:
AG0047XS
Chemical Name:
Benzenethiol, 4-(2-ethoxyethoxy)-
CAS Number:
88318-15-4
Molecular Formula:
C10H14O2S
Molecular Weight:
198.2820
IUPAC Name:
4-(2-ethoxyethoxy)benzenethiol
InChI:
InChI=1S/C10H14O2S/c1-2-11-7-8-12-9-3-5-10(13)6-4-9/h3-6,13H,2,7-8H2,1H3
InChI Key:
SRRKWUOXHQCTAA-UHFFFAOYSA-N
SMILES:
CCOCCOc1ccc(cc1)S

Properties

Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.071g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.28g/mol
Monoisotopic Mass:
198.071g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
19.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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