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30084-91-4 | Indan-5-carboxaldehyde
CAS No: 30084-91-4 Catalog No: AG007JKS MDL No:MFCD00086208
Product Description
Catalog Number:
AG007JKS
Chemical Name:
Indan-5-carboxaldehyde
CAS Number:
30084-91-4
Molecular Formula:
C10H10O
Molecular Weight:
146.1858
MDL Number:
MFCD00086208
IUPAC Name:
2,3-dihydro-1H-indene-5-carbaldehyde
InChI:
InChI=1S/C10H10O/c11-7-8-4-5-9-2-1-3-10(9)6-8/h4-7H,1-3H2
InChI Key:
YNGGRNROMJXLCP-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)CCC2
EC Number:
250-036-8
UNII:
V816D1X892
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.073g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.189g/mol
Monoisotopic Mass:
146.073g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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