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88959-38-0 | Propanoic acid, 3-bromo-2-(methoxyimino)-, ethyl ester
CAS No: 88959-38-0 Catalog No: AG0047SJ MDL No:
Product Description
Catalog Number:
AG0047SJ
Chemical Name:
Propanoic acid, 3-bromo-2-(methoxyimino)-, ethyl ester
CAS Number:
88959-38-0
Molecular Formula:
C6H10BrNO3
Molecular Weight:
224.0525
IUPAC Name:
ethyl 3-bromo-2-methoxyiminopropanoate
InChI:
InChI=1S/C6H10BrNO3/c1-3-11-6(9)5(4-7)8-10-2/h3-4H2,1-2H3
InChI Key:
HKKNVZIWTKMDLH-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=NOC)CBr
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.984g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.054g/mol
Monoisotopic Mass:
222.984g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.7
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