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1258283-17-8

1258283-17-8 | 5-Oxazolecarboxylic acid, 4-bromo-, ethyl ester

CAS No: 1258283-17-8 Catalog No: AG000OSU MDL No:MFCD20260216

Product Description

Catalog Number:
AG000OSU
Chemical Name:
5-Oxazolecarboxylic acid, 4-bromo-, ethyl ester
CAS Number:
1258283-17-8
Molecular Formula:
C6H6BrNO3
Molecular Weight:
220.0207
MDL Number:
MFCD20260216
IUPAC Name:
ethyl 4-bromo-1,3-oxazole-5-carboxylate
InChI:
InChI=1S/C6H6BrNO3/c1-2-10-6(9)4-5(7)8-3-11-4/h3H,2H2,1H3
InChI Key:
ARPHYGHAUCJWCC-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ocnc1Br

Properties

Complexity:
153  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.953g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.022g/mol
Monoisotopic Mass:
218.953g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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