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101692-74-4 | 5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-, (6R)-
CAS No: 101692-74-4 Catalog No: AG00058G MDL No:MFCD20486726
Product Description
Catalog Number:
AG00058G
Chemical Name:
5H-Benzocyclohepten-6-amine, 6,7,8,9-tetrahydro-, (6R)-
CAS Number:
101692-74-4
Molecular Formula:
C11H15N
Molecular Weight:
161.2435
MDL Number:
MFCD20486726
IUPAC Name:
(6R)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-amine
InChI:
InChI=1S/C11H15N/c12-11-7-3-6-9-4-1-2-5-10(9)8-11/h1-2,4-5,11H,3,6-8,12H2/t11-/m1/s1
InChI Key:
MDVRGZASGHPBAG-LLVKDONJSA-N
SMILES:
N[C@@H]1CCCc2c(C1)cccc2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
161.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
161.248g/mol
Monoisotopic Mass:
161.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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