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14790-53-5 | Acetic acid, 2-diazo-2-iodo-, ethyl ester
CAS No: 14790-53-5 Catalog No: AG001FA9 MDL No:
Product Description
Catalog Number:
AG001FA9
Chemical Name:
Acetic acid, 2-diazo-2-iodo-, ethyl ester
CAS Number:
14790-53-5
Molecular Formula:
C4H5IN2O2
Molecular Weight:
239.9992
IUPAC Name:
ethyl 2-diazo-2-iodoacetate
InChI:
InChI=1S/C4H5IN2O2/c1-2-9-4(8)3(5)7-6/h2H2,1H3
InChI Key:
VITWMEKLTZLBJO-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C(C(=O)OCC)I
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.94g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240g/mol
Monoisotopic Mass:
239.94g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
28.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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