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Home > Aldehydes > 1855469-83-8
1855469-83-8 | 2-(3-ethyl-3-hydroxyazetidin-1-yl)benzaldehyde
CAS No: 1855469-83-8 Catalog No: AG01C8UB MDL No:MFCD31443285
Product Description
Catalog Number:
AG01C8UB
Chemical Name:
2-(3-ethyl-3-hydroxyazetidin-1-yl)benzaldehyde
CAS Number:
1855469-83-8
Molecular Formula:
C12H15NO2
Molecular Weight:
205.2530
MDL Number:
MFCD31443285
IUPAC Name:
2-(3-ethyl-3-hydroxyazetidin-1-yl)benzaldehyde
InChI:
InChI=1S/C12H15NO2/c1-2-12(15)8-13(9-12)11-6-4-3-5-10(11)7-14/h3-7,15H,2,8-9H2,1H3
InChI Key:
HDMFJVQAIWPLPO-UHFFFAOYSA-N
SMILES:
CCC1(O)CN(C1)c1ccccc1C=O
Properties
Complexity:
236
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:
1
Isotope Atom Count:
0
Molecular Weight:
205.257g/mol
Monoisotopic Mass:
205.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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