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15945-03-6 | Butane, 1-chloro-4-(2-chloroethoxy)-
CAS No: 15945-03-6 Catalog No: AG001QPQ MDL No:
Product Description
Catalog Number:
AG001QPQ
Chemical Name:
Butane, 1-chloro-4-(2-chloroethoxy)-
CAS Number:
15945-03-6
Molecular Formula:
C6H12Cl2O
Molecular Weight:
171.0649
IUPAC Name:
1-chloro-4-(2-chloroethoxy)butane
InChI:
InChI=1S/C6H12Cl2O/c7-3-1-2-5-9-6-4-8/h1-6H2
InChI Key:
SGXVVLYHQNNOLF-UHFFFAOYSA-N
SMILES:
ClCCCCOCCCl
Properties
Complexity:
50.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.027g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.061g/mol
Monoisotopic Mass:
170.027g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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