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Home > Aldehydes > 1861114-51-3
1861114-51-3 | 4-chloro-2-(3-hydroxy-3-methylazetidin-1-yl)benzaldehyde
CAS No: 1861114-51-3 Catalog No: AG01C8V0 MDL No:MFCD31443304
Product Description
Catalog Number:
AG01C8V0
Chemical Name:
4-chloro-2-(3-hydroxy-3-methylazetidin-1-yl)benzaldehyde
CAS Number:
1861114-51-3
Molecular Formula:
C11H12ClNO2
Molecular Weight:
225.6715
MDL Number:
MFCD31443304
IUPAC Name:
4-chloro-2-(3-hydroxy-3-methylazetidin-1-yl)benzaldehyde
InChI:
InChI=1S/C11H12ClNO2/c1-11(15)6-13(7-11)10-4-9(12)3-2-8(10)5-14/h2-5,15H,6-7H2,1H3
InChI Key:
VGWRFKSMISPEAZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1N1CC(C1)(C)O)Cl
Properties
Complexity:
253
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.672g/mol
Monoisotopic Mass:
225.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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