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Home > Aldehydes > 1872095-08-3
1872095-08-3 | 2-(azetidin-1-yl)-5-nitrobenzaldehyde
CAS No: 1872095-08-3 Catalog No: AG01C8SA MDL No:MFCD30203492
Product Description
Catalog Number:
AG01C8SA
Chemical Name:
2-(azetidin-1-yl)-5-nitrobenzaldehyde
CAS Number:
1872095-08-3
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
MDL Number:
MFCD30203492
IUPAC Name:
2-(azetidin-1-yl)-5-nitrobenzaldehyde
InChI:
InChI=1S/C10H10N2O3/c13-7-8-6-9(12(14)15)2-3-10(8)11-4-1-5-11/h2-3,6-7H,1,4-5H2
InChI Key:
NOOHYVBDBMMBPM-UHFFFAOYSA-N
SMILES:
O=Cc1cc(ccc1N1CCC1)[N+](=O)[O-]
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
66.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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