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101283-00-5 | 2-Pyrenamine, 4,5,9,10-tetrahydro-
CAS No: 101283-00-5 Catalog No: AG000459 MDL No:
Product Description
Catalog Number:
AG000459
Chemical Name:
2-Pyrenamine, 4,5,9,10-tetrahydro-
CAS Number:
101283-00-5
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
IUPAC Name:
4,5,9,10-tetrahydropyren-2-amine
InChI:
InChI=1S/C16H15N/c17-14-8-12-6-4-10-2-1-3-11-5-7-13(9-14)16(12)15(10)11/h1-3,8-9H,4-7,17H2
InChI Key:
STSFAROQOOSKCM-UHFFFAOYSA-N
SMILES:
Nc1cc2CCc3c4c2c(c1)CCc4ccc3
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.303g/mol
Monoisotopic Mass:
221.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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