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139138-16-2 | 2-Propanol, 2-(2-chloroethoxy)-
CAS No: 139138-16-2 Catalog No: AG001AD4 MDL No:
Product Description
Catalog Number:
AG001AD4
Chemical Name:
2-Propanol, 2-(2-chloroethoxy)-
CAS Number:
139138-16-2
Molecular Formula:
C5H11ClO2
Molecular Weight:
138.5926
IUPAC Name:
2-(2-chloroethoxy)propan-2-ol
InChI:
InChI=1S/C5H11ClO2/c1-5(2,7)8-4-3-6/h7H,3-4H2,1-2H3
InChI Key:
OFIKCFHGGACOAT-UHFFFAOYSA-N
SMILES:
ClCCOC(O)(C)C
Properties
Complexity:
63.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.045g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.591g/mol
Monoisotopic Mass:
138.045g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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