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88379-95-7 | 4,7-Methano-1H-indenedimethanamine, 3a,4,7,7a-tetrahydro-
CAS No: 88379-95-7 Catalog No: AG004FRM MDL No:
Product Description
Catalog Number:
AG004FRM
Chemical Name:
4,7-Methano-1H-indenedimethanamine, 3a,4,7,7a-tetrahydro-
CAS Number:
88379-95-7
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
IUPAC Name:
[4-(aminomethyl)-3-tricyclo[5.2.1.02,6]deca-4,8-dienyl]methanamine
InChI:
InChI=1S/C12H18N2/c13-5-9-4-10-7-1-2-8(3-7)12(10)11(9)6-14/h1-2,4,7-8,10-12H,3,5-6,13-14H2
InChI Key:
YEQBYGLPDJBAHA-UHFFFAOYSA-N
SMILES:
NCC1C(=CC2C1C1C=CC2C1)CN
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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