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Home > Other Heterocycles > 204327-16-2
204327-16-2 | 2-Azabicyclo[2.2.1]heptane-3-methanol, (1S,3R,4R)-
CAS No: 204327-16-2 Catalog No: AG0029G1 MDL No:
Product Description
Catalog Number:
AG0029G1
Chemical Name:
2-Azabicyclo[2.2.1]heptane-3-methanol, (1S,3R,4R)-
CAS Number:
204327-16-2
Molecular Formula:
C7H13NO
Molecular Weight:
127.1842
IUPAC Name:
[(1S,3R,4R)-2-azabicyclo[2.2.1]heptan-3-yl]methanol
InChI:
InChI=1S/C7H13NO/c9-4-7-5-1-2-6(3-5)8-7/h5-9H,1-4H2/t5-,6+,7+/m1/s1
InChI Key:
CKGOIZORGVFPFX-VQVTYTSYSA-N
SMILES:
OC[C@@H]1N[C@@H]2C[C@H]1CC2
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
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:
2
Isotope Atom Count:
0
Molecular Weight:
127.187g/mol
Monoisotopic Mass:
127.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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