CAS
945606-99-5 Purity
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945606-99-5 Purity
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![(3s,12As)-1,2,3,4,6,7,12,12a-octahydro-1,4-dioxo-pyrazino[1',2':1,6]pyrido[3,4-b]indole-3-propanoic acid phenylmethyl ester](https://resource.alfa-chemistry.com/structure/945651-06-9.gif)
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2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone
CAS
945632-77-9
Catalog Number
ACM945632779
Category
Other Products
Molecular Weight
337.29
Molecular Formula
C18H25BrO
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Specification
Density
1.209
What is the molecular formula of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The molecular formula is C18H25BrO.
When was 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone first created and modified in PubChem?
It was first created on 2011-10-30 and last modified on 2023-12-30.
What is the IUPAC name of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The IUPAC name is 2-bromo-6-octyl-3,4-dihydro-2H-naphthalen-1-one.
What is the InChIKey of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The InChIKey is ZBADJFWIUJXHTL-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The Canonical SMILES is CCCCCCCCC1=CC2=C(C=C1)C(=O)C(CC2)Br.
What is the XLogP3-AA value of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The XLogP3-AA value is 7.
How many Rotatable Bond Count does 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone have?
It has 7 Rotatable Bond Count.
What is the Heavy Atom Count of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The Heavy Atom Count is 20.
Is 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone a Canonicalized compound in PubChem?
Yes, it is a Canonicalized compound.
What is the Topological Polar Surface Area of 2-Bromo-3,4-dihydro-6-octyl-1(2H)-naphthalenone?
The Topological Polar Surface Area is 17.1 2.
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