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138418-40-3 | Propane, 1,3-bis(chloromethoxy)-
CAS No: 138418-40-3 Catalog No: AG00192V MDL No:
Product Description
Catalog Number:
AG00192V
Chemical Name:
Propane, 1,3-bis(chloromethoxy)-
CAS Number:
138418-40-3
Molecular Formula:
C5H10Cl2O2
Molecular Weight:
173.0377
IUPAC Name:
1,3-bis(chloromethoxy)propane
InChI:
InChI=1S/C5H10Cl2O2/c6-4-8-2-1-3-9-5-7/h1-5H2
InChI Key:
PVWXTRJGIZAZDL-UHFFFAOYSA-N
SMILES:
ClCOCCCOCCl
Properties
Complexity:
46.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.006g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.033g/mol
Monoisotopic Mass:
172.006g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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