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10262-69-8 | 9,10-Ethanoanthracene-9(10H)-propanamine, N-methyl-
CAS No: 10262-69-8 Catalog No: AG0007Y8 MDL No:MFCD00661057
Product Description
Catalog Number:
AG0007Y8
Chemical Name:
9,10-Ethanoanthracene-9(10H)-propanamine, N-methyl-
CAS Number:
10262-69-8
Molecular Formula:
C20H23N
Molecular Weight:
277.4033
MDL Number:
MFCD00661057
IUPAC Name:
N-methyl-3-(1-tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaenyl)propan-1-amine
InChI:
InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3
InChI Key:
QSLMDECMDJKHMQ-UHFFFAOYSA-N
SMILES:
CNCCCC12CCC(c3c1cccc3)c1c2cccc1
EC Number:
233-599-4
UNII:
2U1W68TROF
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.411g/mol
Monoisotopic Mass:
277.183g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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