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100243-39-8 | 3-Pyrrolidinol, (3S)-
CAS No: 100243-39-8 Catalog No: AG0001CT MDL No:MFCD00192426
Product Description
Catalog Number:
AG0001CT
Chemical Name:
3-Pyrrolidinol, (3S)-
CAS Number:
100243-39-8
Molecular Formula:
C4H9NO
Molecular Weight:
87.1204
MDL Number:
MFCD00192426
IUPAC Name:
(3S)-pyrrolidin-3-ol
InChI:
InChI=1S/C4H9NO/c6-4-1-2-5-3-4/h4-6H,1-3H2/t4-/m0/s1
InChI Key:
JHHZLHWJQPUNKB-BYPYZUCNSA-N
SMILES:
O[C@@H]1CNCC1
Properties
Complexity:
46.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
87.068g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
87.122g/mol
Monoisotopic Mass:
87.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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