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Home > Aldehydes > 682802-87-5
682802-87-5 | INDOLE-3,5-DIALDEHYDE
CAS No: 682802-87-5 Catalog No: AG005LHA MDL No:MFCD02683890
Product Description
Catalog Number:
AG005LHA
Chemical Name:
INDOLE-3,5-DIALDEHYDE
CAS Number:
682802-87-5
Molecular Formula:
C10H7NO2
Molecular Weight:
173.1681
MDL Number:
MFCD02683890
IUPAC Name:
1H-indole-3,5-dicarbaldehyde
InChI:
InChI=1S/C10H7NO2/c12-5-7-1-2-10-9(3-7)8(6-13)4-11-10/h1-6,11H
InChI Key:
ZUZXRKSFCBCQIA-UHFFFAOYSA-N
SMILES:
O=Cc1ccc2c(c1)c(C=O)c[nH]2
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.171g/mol
Monoisotopic Mass:
173.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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