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Home > Aldehydes > 207298-34-8
207298-34-8 | Benzaldehyde, 5-(3-hydroxypropoxy)-2-nitro-
CAS No: 207298-34-8 Catalog No: AG002IYF MDL No:
Product Description
Catalog Number:
AG002IYF
Chemical Name:
Benzaldehyde, 5-(3-hydroxypropoxy)-2-nitro-
CAS Number:
207298-34-8
Molecular Formula:
C10H11NO5
Molecular Weight:
225.1980
IUPAC Name:
5-(3-hydroxypropoxy)-2-nitrobenzaldehyde
InChI:
InChI=1S/C10H11NO5/c12-4-1-5-16-9-2-3-10(11(14)15)8(6-9)7-13/h2-3,6-7,12H,1,4-5H2
InChI Key:
NJWLMMIPAPQNIZ-UHFFFAOYSA-N
SMILES:
OCCCOc1ccc(c(c1)C=O)[N+](=O)[O-]
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.064g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.2g/mol
Monoisotopic Mass:
225.064g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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