CAS
959241-31-7 Purity
96%
959241-31-7 Purity
96%
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(6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid
CAS
959241-55-5
Catalog Number
ACM959241555
Category
Other Products
Molecular Weight
205.209940 [g/mol]
Molecular Formula
C11H11NO3
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Specification
Synonyms
(6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid, 959241-55-5, Ambcb4402021, SureCN14485127, CTK5H8417, MolPort-016-583-480, AKOS006340219, AG-H-94457, MCULE-9166667219, KB-209011
IUPAC Name
2-(6-methyl-2-oxo-1,3-dihydroindol-3-yl)acetic acid
SMILES
CC1=CC2=C(C=C1)C(C(=O)N2)CC(=O)O
InChI Key
KKDSTULRLHTHJN-UHFFFAOYSA-N
Boiling Point
444.7ºC at 760 mmHg
Flash Point
222.8ºC
Density
1.286g/cm³
Exact Mass
205.07400
H-Bond Acceptor
3
H-Bond Donor
2
What is the molecular formula of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The molecular formula is C11H11NO3.
What is the PubChem CID of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The PubChem CID is 45791296.
What is the IUPAC name of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The IUPAC name is 2-(6-methyl-2-oxo-1,3-dihydroindol-3-yl)acetic acid.
What is the InChI of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The InChI is InChI=1S/C11H11NO3/c1-6-2-3-7-8(5-10(13)14)11(15)12-9(7)4-6/h2-4,8H,5H2,1H3,(H,12,15)(H,13,14).
What is the InChIKey of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The InChIKey is KKDSTULRLHTHJN-UHFFFAOYSA-N.
What is the canonical SMILES of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The canonical SMILES is CC1=CC2=C(C=C1)C(C(=O)N2)CC(=O)O.
What is the molecular weight of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The molecular weight is 205.21 g/mol.
What is the XLogP3-AA of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The XLogP3-AA is 0.7.
What is the hydrogen bond donor count of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The hydrogen bond donor count is 2.
What is the hydrogen bond acceptor count of (6-Methyl-2-oxo-2,3-dihydro-1H-indol-3-yl)acetic acid?
The hydrogen bond acceptor count is 3.
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