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1270019-87-8 | 3-Oxetaneacetic acid, α-amino-
CAS No: 1270019-87-8 Catalog No: AG000WJ7 MDL No:MFCD17392891
Product Description
Catalog Number:
AG000WJ7
Chemical Name:
3-Oxetaneacetic acid, α-amino-
CAS Number:
1270019-87-8
Molecular Formula:
C5H9NO3
Molecular Weight:
131.1299
MDL Number:
MFCD17392891
IUPAC Name:
2-amino-2-(oxetan-3-yl)acetic acid
InChI:
InChI=1S/C5H9NO3/c6-4(5(7)8)3-1-9-2-3/h3-4H,1-2,6H2,(H,7,8)
InChI Key:
RMQBFQWTJJLVRW-UHFFFAOYSA-N
SMILES:
NC(C(=O)O)C1COC1
Properties
Complexity:
121
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:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
131.131g/mol
Monoisotopic Mass:
131.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.5
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