Home Other Building Blocks 3-(propan-2-yl)-2,3-dihydro-1H-inden-1-one

3-(propan-2-yl)-2,3-dihydro-1H-inden-1-one

CAS No.:
22531-07-3
Catalog Number:
AG01BER8
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
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Product Description
Catalog Number:
AG01BER8
Chemical Name:
3-(propan-2-yl)-2,3-dihydro-1H-inden-1-one
CAS Number:
22531-07-3
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
MDL Number:
MFCD16301548
IUPAC Name:
3-propan-2-yl-2,3-dihydroinden-1-one
InChI:
InChI=1S/C12H14O/c1-8(2)11-7-12(13)10-6-4-3-5-9(10)11/h3-6,8,11H,7H2,1-2H3
InChI Key:
HGKUHNKHAFJFPW-UHFFFAOYSA-N
SMILES:
CC(C1CC(=O)c2c1cccc2)C
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties