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24778-81-2 | 1H-Indene, 3a,7a-dihydro-, (3aR,7aS)-rel-
CAS No: 24778-81-2 Catalog No: AG002PEH MDL No:
Product Description
Catalog Number:
AG002PEH
Chemical Name:
1H-Indene, 3a,7a-dihydro-, (3aR,7aS)-rel-
CAS Number:
24778-81-2
Molecular Formula:
C9H10
Molecular Weight:
118.1757
IUPAC Name:
(3aR,7aS)-3a,7a-dihydro-1H-indene
InChI:
InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-6,8-9H,7H2/t8-,9+/m0/s1
InChI Key:
ZASATNXXFMERCZ-DTWKUNHWSA-N
SMILES:
C1=C[C@@H]2[C@H](C=C1)CC=C2
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
118.078g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
118.179g/mol
Monoisotopic Mass:
118.078g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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