Home Halogens chloromethyl propionate

chloromethyl propionate

CAS No.:
5402-53-9
Catalog Number:
AG01BTWO
Molecular Formula:
C4H7ClO2
Molecular Weight:
122.5502
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Product Description
Catalog Number:
AG01BTWO
Chemical Name:
chloromethyl propionate
CAS Number:
5402-53-9
Molecular Formula:
C4H7ClO2
Molecular Weight:
122.5502
MDL Number:
MFCD19231959
IUPAC Name:
chloromethyl propanoate
InChI:
InChI=1S/C4H7ClO2/c1-2-4(6)7-3-5/h2-3H2,1H3
InChI Key:
BTBBPNVBJSIADI-UHFFFAOYSA-N
SMILES:
ClCOC(=O)CC
NSC Number:
5134
Properties
Complexity:
62.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
122.013g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
122.548g/mol
Monoisotopic Mass:
122.013g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties