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1273567-00-2 | Pyrrolidine, 3-(3-oxetanyl)-
CAS No: 1273567-00-2 Catalog No: AG000WYM MDL No:MFCD18793263
Product Description
Catalog Number:
AG000WYM
Chemical Name:
Pyrrolidine, 3-(3-oxetanyl)-
CAS Number:
1273567-00-2
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
MDL Number:
MFCD18793263
IUPAC Name:
3-(oxetan-3-yl)pyrrolidine
InChI:
InChI=1S/C7H13NO/c1-2-8-3-6(1)7-4-9-5-7/h6-8H,1-5H2
InChI Key:
MXASJDNDNLHYAN-UHFFFAOYSA-N
SMILES:
O1CC(C1)C1CCNC1
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.1g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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