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1021237-95-5 | 4-(2-METHYLMORPHOLIN-4-YL)BENZALDEHYDE
CAS No: 1021237-95-5 Catalog No: AG01C8ML MDL No:MFCD11156361
Product Description
Catalog Number:
AG01C8ML
Chemical Name:
4-(2-METHYLMORPHOLIN-4-YL)BENZALDEHYDE
CAS Number:
1021237-95-5
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD11156361
IUPAC Name:
4-(2-methylmorpholin-4-yl)benzaldehyde
InChI:
InChI=1S/C12H15NO2/c1-10-8-13(6-7-15-10)12-4-2-11(9-14)3-5-12/h2-5,9-10H,6-8H2,1H3
InChI Key:
NQENCOQTLRAHEH-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N1CCOC(C1)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:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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