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1554258-55-7 | 2-[METHYL(OXOLAN-3-YL)AMINO]BENZALDEHYDE
CAS No: 1554258-55-7 Catalog No: AG01C8JR MDL No:MFCD24298825
Product Description
Catalog Number:
AG01C8JR
Chemical Name:
2-[METHYL(OXOLAN-3-YL)AMINO]BENZALDEHYDE
CAS Number:
1554258-55-7
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD24298825
IUPAC Name:
2-[methyl(oxolan-3-yl)amino]benzaldehyde
InChI:
InChI=1S/C12H15NO2/c1-13(11-6-7-15-9-11)12-5-3-2-4-10(12)8-14/h2-5,8,11H,6-7,9H2,1H3
InChI Key:
YKJCZCTWNRYSOD-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1N(C1COCC1)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.11g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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