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24188-74-7 | 7-Chloroisoquinolin-1-ol
CAS No: 24188-74-7 Catalog No: AG003NET MDL No:MFCD08436984
Product Description
Catalog Number:
AG003NET
Chemical Name:
7-Chloroisoquinolin-1-ol
CAS Number:
24188-74-7
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
MDL Number:
MFCD08436984
IUPAC Name:
7-chloro-2H-isoquinolin-1-one
InChI:
InChI=1S/C9H6ClNO/c10-7-2-1-6-3-4-11-9(12)8(6)5-7/h1-5H,(H,11,12)
InChI Key:
YWUCOQGBXQHOJM-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(c1)c(O)ncc2
EC Number:
813-122-1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.014g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.603g/mol
Monoisotopic Mass:
179.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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