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Home > Aldehydes > 1537415-87-4
1537415-87-4 | 6-CHLOROISOQUINOLINE-1-CARBALDEHYDE
CAS No: 1537415-87-4 Catalog No: AG01EM98 MDL No:MFCD22099600
Product Description
Catalog Number:
AG01EM98
Chemical Name:
6-CHLOROISOQUINOLINE-1-CARBALDEHYDE
CAS Number:
1537415-87-4
Molecular Formula:
C10H6ClNO
Molecular Weight:
191.6137
MDL Number:
MFCD22099600
IUPAC Name:
6-chloroisoquinoline-1-carbaldehyde
InChI:
InChI=1S/C10H6ClNO/c11-8-1-2-9-7(5-8)3-4-12-10(9)6-13/h1-6H
InChI Key:
YEXAAUPVBQXJPF-UHFFFAOYSA-N
SMILES:
O=Cc1nccc2c1ccc(c2)Cl
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.014g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.614g/mol
Monoisotopic Mass:
191.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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