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1807542-91-1 | 1-Azetidinecarboxylic acid, 2-(hydroxymethyl)-
CAS No: 1807542-91-1 Catalog No: AG0022B1 MDL No:
Product Description
Catalog Number:
AG0022B1
Chemical Name:
1-Azetidinecarboxylic acid, 2-(hydroxymethyl)-
CAS Number:
1807542-91-1
Molecular Formula:
C5H9NO3
Molecular Weight:
131.1299
IUPAC Name:
2-(hydroxymethyl)azetidine-1-carboxylic acid
InChI:
InChI=1S/C5H9NO3/c7-3-4-1-2-6(4)5(8)9/h4,7H,1-3H2,(H,8,9)
InChI Key:
STDVCZWWAATUKN-UHFFFAOYSA-N
SMILES:
OCC1CCN1C(=O)O
Properties
Complexity:
125
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
131.058g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
131.131g/mol
Monoisotopic Mass:
131.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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