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83461-86-3 | 1,4-Methanonaphthalen-2-amine, 1,2,3,4-tetrahydro-
CAS No: 83461-86-3 Catalog No: AG004ROI MDL No:
Product Description
Catalog Number:
AG004ROI
Chemical Name:
1,4-Methanonaphthalen-2-amine, 1,2,3,4-tetrahydro-
CAS Number:
83461-86-3
Molecular Formula:
C11H13N
Molecular Weight:
159.2276
IUPAC Name:
tricyclo[6.2.1.02,7]undeca-2,4,6-trien-9-amine
InChI:
InChI=1S/C11H13N/c12-11-6-7-5-10(11)9-4-2-1-3-8(7)9/h1-4,7,10-11H,5-6,12H2
InChI Key:
NVPNUMDAUYTNLJ-UHFFFAOYSA-N
SMILES:
NC1CC2CC1c1c2cccc1
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.105g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
159.232g/mol
Monoisotopic Mass:
159.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Phenylethanolamine N-methyltransferase kinetics: bovine versus recombinant human enzyme. | Bioorganic & medicinal chemistry letters 20010618 |
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