Butanoic acid, chloromethyl ester


Chemical Name: Butanoic acid, chloromethyl ester
CAS Number: 33657-49-7
Product Number: AG007CT5(AGN-PC-0KK0JL)
Synonyms:
MDL No: MFCD00216961
Molecular Formula: C5H9ClO2
Molecular Weight: 136.5768

Identification/Properties


Computed Properties
Molecular Weight:
136.575g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
4
Exact Mass:
136.029g/mol
Monoisotopic Mass:
136.029g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
72.8
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2924
Hazard Statements:
H226-H314
Precautionary Statements:
P210-P233-P240-P241+P242+P243-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P370+P378-P403+P235-P405-P501
Class:
3,8
Packing Group:

NMR Spectrum


Other Analytical Data


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