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Structure

3A,4,7,7A-TETRAHYDROINDENE

CAS
3048-65-5
Catalog Number
ACM3048655
Category
Other Products
Molecular Weight
120.19g/mol
Molecular Formula
C9H12

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Specification

Description
Liquid
IUPAC Name
3a,4,7,7a-tetrahydro-1H-indene
Canonical SMILES
C1C=CCC2C1CC=C2
InChI
InChI=1S/C9H12/c1-2-5-9-7-3-6-8(9)4-1/h1-3,6,8-9H,4-5,7H2
InChI Key
UFERIGCCDYCZLN-UHFFFAOYSA-N
Complexity
153
Covalently-Bonded Unit Count
1
EC Number
221-260-3
Exact Mass
120.0939g/mol
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
9
Monoisotopic Mass
120.0939g/mol
Rotatable Bond Count
0
UNII
37G13UD607
XLogP3
2.6
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