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3587-58-4 | Chloromethyl isopropyl ether
CAS No: 3587-58-4 Catalog No: AG00380F MDL No:MFCD00040317
Product Description
Catalog Number:
AG00380F
Chemical Name:
Chloromethyl isopropyl ether
CAS Number:
3587-58-4
Molecular Formula:
C4H9ClO
Molecular Weight:
108.5667
MDL Number:
MFCD00040317
IUPAC Name:
2-(chloromethoxy)propane
InChI:
InChI=1S/C4H9ClO/c1-4(2)6-3-5/h4H,3H2,1-2H3
InChI Key:
GSGPUGZLDGHFDO-UHFFFAOYSA-N
SMILES:
ClCOC(C)C
Properties
Complexity:
28.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.034g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
108.565g/mol
Monoisotopic Mass:
108.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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