CAS
95641-39-7 Purity
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95641-39-7 Purity
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4-Fluoro-1,3-dihydro-pyrrolo[2,3-b]pyridin-2-one
CAS
956460-93-8
Catalog Number
ACM956460938
Category
Other Products
Molecular Weight
152.128
Molecular Formula
C7H5N2OF
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Specification
Synonyms
4-Fluoro-1H-pyrrolo[2,3-b]pyridin-2(3H)-one, 956460-93-8, 4-Fluoro-1,3-dihydro-pyrrolo[2,3-b]pyridin-2-one, SureCN2782735, CTK8B6579, 4-FLUORO-7-AZA-2-OXINDOLE, ANW-53693, AKOS015949335, PB11030, RP09001, AK-64386, KB-38629, AM20061642, FT-0660553, X6198, 4-fluoro-1H,3H-pyrrolo[2,3-b]pyridin-2-one, 4-Fluoro-1,3-dihydropyrrolo[2,3-b]pyridin-2-one, 4-fluoro-1H,2H,3H-pyrrolo[2,3-b]pyridin-2-one, 4-FLUORO-1,3-DIHYDRO-2H-PYRROLO[2,3-B]PYRIDIN-2-ONE, 2H-PYRROLO[2,3-B]PYRIDIN-2-ONE, 4-FLUORO-1,3-DIHYDRO-
IUPAC Name
4-fluoro-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
Canonical SMILES
C1C2=C(C=CN=C2NC1=O)F
InChI Key
CNWDXMBVANPUCX-UHFFFAOYSA-N
Exact Mass
152.03900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 57416920?
The molecular formula is C7H5FN2O.
What is the molecular weight of the compound?
The molecular weight is 152.13 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 4-fluoro-1,3-dihydropyrrolo[2,3-b]pyridin-2-one.
What is the InChI representation of the compound?
The InChI representation is InChI=1S/C7H5FN2O/c8-5-1-2-9-7-4(5)3-6(11)10-7/h1-2H,3H2,(H,9,10,11).
What is the InChIKey of the compound?
The InChIKey is CNWDXMBVANPUCX-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is C1C2=C(C=CN=C2NC1=O)F.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 0.1.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
What is the topological polar surface area of the compound?
The topological polar surface area is 42 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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95646-75-6 Purity
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