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Home > Other Heterocycles > 2007916-47-2
2007916-47-2 | 3-Azabicyclo[3.1.1]heptane-6-methanol, hydrochloride (1:1)
CAS No: 2007916-47-2 Catalog No: AG002CYP MDL No:
Product Description
Catalog Number:
AG002CYP
Chemical Name:
3-Azabicyclo[3.1.1]heptane-6-methanol, hydrochloride (1:1)
CAS Number:
2007916-47-2
Molecular Formula:
C7H14ClNO
Molecular Weight:
163.6452
IUPAC Name:
3-azabicyclo[3.1.1]heptan-6-ylmethanol;hydrochloride
InChI:
InChI=1S/C7H13NO.ClH/c9-4-7-5-1-6(7)3-8-2-5;/h5-9H,1-4H2;1H
InChI Key:
OTRDUUMXEJHALE-UHFFFAOYSA-N
SMILES:
OCC1C2CNCC1C2.Cl
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.076g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
163.645g/mol
Monoisotopic Mass:
163.076g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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