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1547122-10-0 | 4-[METHYL(OXOLAN-3-YL)AMINO]BENZALDEHYDE
CAS No: 1547122-10-0 Catalog No: AG01C8MQ MDL No:MFCD24298819
Product Description
Catalog Number:
AG01C8MQ
Chemical Name:
4-[METHYL(OXOLAN-3-YL)AMINO]BENZALDEHYDE
CAS Number:
1547122-10-0
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD24298819
IUPAC Name:
4-[methyl(oxolan-3-yl)amino]benzaldehyde
InChI:
InChI=1S/C12H15NO2/c1-13(12-6-7-15-9-12)11-4-2-10(8-14)3-5-11/h2-5,8,12H,6-7,9H2,1H3
InChI Key:
VKXUYCWFANGEOF-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N(C1COCC1)C
Properties
Complexity:
212
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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