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Structure

7-Hydroxy-4-methoxy-1-indanone

CAS
98154-04-2
Catalog Number
ACM98154042
Category
Other Products
Molecular Weight
178.184600 [g/mol]
Molecular Formula
C10H10O3

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Specification

Synonyms
1H-Inden-1-one, 2,3-dihydro-7-hydroxy-4-methoxy-, AGN-PC-00MLNR, 7-Hydroxy-4-methoxy-1-indanone, AM1233, AKOS006311469, 98154-04-2
IUPAC Name
7-hydroxy-4-methoxy-2,3-dihydroinden-1-one
Canonical SMILES
COC1=C2CCC(=O)C2=C(C=C1)O
InChI Key
GTDPFEVASSGTHY-UHFFFAOYSA-N
Exact Mass
178.06300
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 7-Hydroxy-4-methoxy-1-indanone?

The molecular formula of 7-Hydroxy-4-methoxy-1-indanone is C10H10O3.

When was the structure of 7-Hydroxy-4-methoxy-1-indanone created?

The structure of 7-Hydroxy-4-methoxy-1-indanone was created on February 8, 2007.

What is the molecular weight of 7-Hydroxy-4-methoxy-1-indanone?

The molecular weight of 7-Hydroxy-4-methoxy-1-indanone is 178.18 g/mol.

What is the IUPAC name of 7-Hydroxy-4-methoxy-1-indanone?

The IUPAC name of 7-Hydroxy-4-methoxy-1-indanone is 7-hydroxy-4-methoxy-2,3-dihydroinden-1-one.

What is the Canonical SMILES of 7-Hydroxy-4-methoxy-1-indanone?

The Canonical SMILES of 7-Hydroxy-4-methoxy-1-indanone is COC1=C2CCC(=O)C2=C(C=C1)O.

What is the InChIKey of 7-Hydroxy-4-methoxy-1-indanone?

The InChIKey of 7-Hydroxy-4-methoxy-1-indanone is GTDPFEVASSGTHY-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 7-Hydroxy-4-methoxy-1-indanone have?

7-Hydroxy-4-methoxy-1-indanone has 1 hydrogen bond donor count.

What is the topological polar surface area of 7-Hydroxy-4-methoxy-1-indanone?

The topological polar surface area of 7-Hydroxy-4-methoxy-1-indanone is 46.5 Ų.

Does 7-Hydroxy-4-methoxy-1-indanone have any defined atom stereocenter count?

No, 7-Hydroxy-4-methoxy-1-indanone does not have any defined atom stereocenter count.

Is 7-Hydroxy-4-methoxy-1-indanone a canonicalized compound?

Yes, 7-Hydroxy-4-methoxy-1-indanone is a canonicalized compound.

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