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113851-95-9 | Acetic acid, 2-diazo-, 2-(dibutylamino)ethyl ester
CAS No: 113851-95-9 Catalog No: AG0009WM MDL No:
Product Description
Catalog Number:
AG0009WM
Chemical Name:
Acetic acid, 2-diazo-, 2-(dibutylamino)ethyl ester
CAS Number:
113851-95-9
Molecular Formula:
C12H23N3O2
Molecular Weight:
241.3299
IUPAC Name:
2-(dibutylamino)ethyl 2-diazoacetate
InChI:
InChI=1S/C12H23N3O2/c1-3-5-7-15(8-6-4-2)9-10-17-12(16)11-14-13/h11H,3-10H2,1-2H3
InChI Key:
SFOXIHXMBOLYET-UHFFFAOYSA-N
SMILES:
CCCCN(CCOC(=O)C=[N+]=[N-])CCCC
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.179g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.335g/mol
Monoisotopic Mass:
241.179g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
31.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.9
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