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Home > Aldehydes > 1860390-09-5
1860390-09-5 | 2-(3-hydroxyazetidin-1-yl)-5-methylbenzaldehyde
CAS No: 1860390-09-5 Catalog No: AG01C8TI MDL No:MFCD31443260
Product Description
Catalog Number:
AG01C8TI
Chemical Name:
2-(3-hydroxyazetidin-1-yl)-5-methylbenzaldehyde
CAS Number:
1860390-09-5
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD31443260
IUPAC Name:
2-(3-hydroxyazetidin-1-yl)-5-methylbenzaldehyde
InChI:
InChI=1S/C11H13NO2/c1-8-2-3-11(9(4-8)7-13)12-5-10(14)6-12/h2-4,7,10,14H,5-6H2,1H3
InChI Key:
RREKJDCFESLLQW-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C)ccc1N1CC(C1)O
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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