2-Thiophenecarboxylic acid, 3-(bromomethyl)-, methyl ester


Chemical Name: 2-Thiophenecarboxylic acid, 3-(bromomethyl)-, methyl ester
CAS Number: 59961-15-8
Product Number: AG00EAP9(AGN-PC-0N66IO)
Synonyms:
MDL No:
Molecular Formula: C7H7BrO2S
Molecular Weight: 235.0983

Identification/Properties


Properties
BP:
310.223°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
235.095g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
233.935g/mol
Monoisotopic Mass:
233.935g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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#:
3265
Hazard Statements:
H302-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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