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51622-82-3

51622-82-3 | Methyl 3-(4-Bromophenyl)oxirane-2-carboxylate

CAS No: 51622-82-3 Catalog No: AG01FAHX MDL No:

Product Description

Catalog Number:
AG01FAHX
Chemical Name:
Methyl 3-(4-Bromophenyl)oxirane-2-carboxylate
CAS Number:
51622-82-3
Molecular Formula:
C10H9BrO3
Molecular Weight:
257.0807
IUPAC Name:
methyl 3-(4-bromophenyl)oxirane-2-carboxylate
InChI:
InChI=1S/C10H9BrO3/c1-13-10(12)9-8(14-9)6-2-4-7(11)5-3-6/h2-5,8-9H,1H3
InChI Key:
XTJKTEOBCCNOOZ-UHFFFAOYSA-N
SMILES:
COC(=O)C1OC1c1ccc(cc1)Br

Properties

Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.974g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.083g/mol
Monoisotopic Mass:
255.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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