Home Aldehydes 1,1-dimethylindan-5-carboxaldehyde

1,1-dimethylindan-5-carboxaldehyde

CAS No.:
343857-09-0
Catalog Number:
AG01DWCW
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
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Product Description
Catalog Number:
AG01DWCW
Chemical Name:
1,1-dimethylindan-5-carboxaldehyde
CAS Number:
343857-09-0
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
MDL Number:
MFCD20483803
IUPAC Name:
1,1-dimethyl-2,3-dihydroindene-5-carbaldehyde
InChI:
InChI=1S/C12H14O/c1-12(2)6-5-10-7-9(8-13)3-4-11(10)12/h3-4,7-8H,5-6H2,1-2H3
InChI Key:
HZDXYCHIJMRKPB-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)CCC2(C)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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties