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1861067-12-0

1861067-12-0 | 5-(3-hydroxy-3-methylazetidin-1-yl)furan-2-carbaldehyde

CAS No: 1861067-12-0 Catalog No: AG01C8UG MDL No:MFCD31443289

Product Description

Catalog Number:
AG01C8UG
Chemical Name:
5-(3-hydroxy-3-methylazetidin-1-yl)furan-2-carbaldehyde
CAS Number:
1861067-12-0
Molecular Formula:
C9H11NO3
Molecular Weight:
181.1885
MDL Number:
MFCD31443289
IUPAC Name:
5-(3-hydroxy-3-methylazetidin-1-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C9H11NO3/c1-9(12)5-10(6-9)8-3-2-7(4-11)13-8/h2-4,12H,5-6H2,1H3
InChI Key:
NNBFZHFTJUFHKZ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)N1CC(C1)(C)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:
181.074g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.191g/mol
Monoisotopic Mass:
181.074g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

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