methyl 3-(1-bromoethyl)benzoate


Chemical Name: methyl 3-(1-bromoethyl)benzoate
CAS Number: 50603-99-1
Product Number: AG003RP9(AGN-PC-02TG49)
Synonyms:
MDL No: MFCD26937555
Molecular Formula: C10H11BrO2
Molecular Weight: 243.0971

Identification/Properties


Properties
Storage:
Room Temperature;Keep in dry area;
Computed Properties
Molecular Weight:
243.1g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
241.994g/mol
Monoisotopic Mass:
241.994g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
182
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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