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5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide

CAS
93923-77-4
Catalog Number
ACM93923774
Category
Other Products
Molecular Weight
238.281160 [g/mol]
Molecular Formula
C16H14O2

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Specification

Synonyms
93923-77-4, EINECS 300-166-7, PL004074, 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide, (5,6-Dihydrofluoranthen)-6a(4H)-yl hydroperoxide, 4,5,6,6A-TETRAHYDROFLUORANTHENE-6A-PEROXOL
IUPAC Name
10b-hydroperoxy-2,3-dihydro-1H-fluoranthene
Canonical SMILES
C1CC2=CC=CC3=C2C(C1)(C4=CC=CC=C34)OO
InChI Key
IXCBSNLRMVSFJK-UHFFFAOYSA-N
Boiling Point
427.7ºC at 760 mmHg
Flash Point
212.5ºC
Density
1.31g/cm³
EC Number
300-166-7
Exact Mass
238.09900
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The molecular formula is C16H14O2.

When was 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide created?

It was created on March 21, 2012.

What is the molecular weight of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The molecular weight is 238.28 g/mol.

What is the InChIKey of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The InChIKey is IXCBSNLRMVSFJK-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide have?

It has 2 hydrogen bond acceptor counts.

What is the topological polar surface area of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The topological polar surface area is 29.5 Å^2.

Is 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide a canonicalized compound?

Yes, it is canonicalized.

What is the exact mass of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The exact mass is 238.099379685 g/mol.

How many rotatable bond counts does 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide have?

It has 1 rotatable bond count.

What is the complexity value of 5,6-Dihydrofluoranthen-6a(4H)-yl hydroperoxide?

The complexity value is 329.

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