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1260788-65-5 | 3-amino-3,6-dihydro-2H-pyran-2-carboxylic acid
CAS No: 1260788-65-5 Catalog No: AG000R9A MDL No:
Product Description
Catalog Number:
AG000R9A
Chemical Name:
3-amino-3,6-dihydro-2H-pyran-2-carboxylic acid
CAS Number:
1260788-65-5
Molecular Formula:
C6H9NO3
Molecular Weight:
143.1406
IUPAC Name:
3-amino-3,6-dihydro-2H-pyran-2-carboxylic acid
InChI:
InChI=1S/C6H9NO3/c7-4-2-1-3-10-5(4)6(8)9/h1-2,4-5H,3,7H2,(H,8,9)
InChI Key:
PDQJVCHMPBCJAK-UHFFFAOYSA-N
SMILES:
OC(=O)C1OCC=CC1N
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.058g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
143.142g/mol
Monoisotopic Mass:
143.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.7
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