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1552466-74-6 | 1H-Pyrrolo[2,3-b]pyridine-3-methanol, 4-chloro-
CAS No: 1552466-74-6 Catalog No: AG001NQP MDL No:MFCD24222249
Product Description
Catalog Number:
AG001NQP
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-methanol, 4-chloro-
CAS Number:
1552466-74-6
Molecular Formula:
C8H7ClN2O
Molecular Weight:
182.6070
MDL Number:
MFCD24222249
IUPAC Name:
(4-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methanol
InChI:
InChI=1S/C8H7ClN2O/c9-6-1-2-10-8-7(6)5(4-12)3-11-8/h1-3,12H,4H2,(H,10,11)
InChI Key:
AAPNTCAQJPIHRU-UHFFFAOYSA-N
SMILES:
OCc1c[nH]c2c1c(Cl)ccn2
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.607g/mol
Monoisotopic Mass:
182.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
48.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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