Home Halogens Carbonic acid, butyl chloromethyl ester

Carbonic acid, butyl chloromethyl ester

CAS No.:
58304-98-6
Catalog Number:
AG00ELMH
Molecular Formula:
C6H11ClO3
Molecular Weight:
166.6027
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Product Description
Catalog Number:
AG00ELMH
Chemical Name:
Carbonic acid, butyl chloromethyl ester
CAS Number:
58304-98-6
Molecular Formula:
C6H11ClO3
Molecular Weight:
166.6027
MDL Number:
MFCD19232413
IUPAC Name:
butyl chloromethyl carbonate
InChI:
InChI=1S/C6H11ClO3/c1-2-3-4-9-6(8)10-5-7/h2-5H2,1H3
InChI Key:
MBUCWFHXWNITCQ-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)OCCl
Properties
Complexity:
95  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.04g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.601g/mol
Monoisotopic Mass:
166.04g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties