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875-22-9 | (1s,7as)-7-(hydroxymethyl)-2,3,5,7a-tetrahydro-1h-pyrrolizin-1-ol hydrochloride(1:1)
CAS No: 875-22-9 Catalog No: AG004F6R MDL No:
Product Description
Catalog Number:
AG004F6R
Chemical Name:
(1s,7as)-7-(hydroxymethyl)-2,3,5,7a-tetrahydro-1h-pyrrolizin-1-ol hydrochloride(1:1)
CAS Number:
875-22-9
Molecular Formula:
C8H14ClNO2
Molecular Weight:
191.6553
IUPAC Name:
(1S,8S)-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-1-ol;hydrochloride
InChI:
InChI=1S/C8H13NO2.ClH/c10-5-6-1-3-9-4-2-7(11)8(6)9;/h1,7-8,10-11H,2-5H2;1H/t7-,8-;/m0./s1
InChI Key:
QGUOKYVLQIMEEC-WSZWBAFRSA-N
SMILES:
OCC1=CCN2[C@@H]1[C@@H](O)CC2.Cl
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
191.071g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
191.655g/mol
Monoisotopic Mass:
191.071g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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