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174-44-7 | 3a,7a-Methano-1H-indene
CAS No: 174-44-7 Catalog No: AG001ZDG MDL No:
Product Description
Catalog Number:
AG001ZDG
Chemical Name:
3a,7a-Methano-1H-indene
CAS Number:
174-44-7
Molecular Formula:
C10H10
Molecular Weight:
130.1864
IUPAC Name:
tricyclo[4.3.1.01,6]deca-2,4,7-triene
InChI:
InChI=1S/C10H10/c1-2-5-10-7-3-6-9(10,4-1)8-10/h1-6H,7-8H2
InChI Key:
HLZPNEAXFWPJJG-UHFFFAOYSA-N
SMILES:
C1=CC23C(C=C1)(C3)CC=C2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.078g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
130.19g/mol
Monoisotopic Mass:
130.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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