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Structure

Hexahydro-6a-pentyl-2H-cyclopenta[b]furan

CAS
94278-33-8
Catalog Number
ACM94278338
Category
Other Products
Molecular Weight
182.302480 [g/mol]
Molecular Formula
C12H22O

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Specification

Synonyms
EINECS 304-723-5, Hexahydro-6a-pentyl-2H-cyclopenta(b)furan, 94278-33-8
IUPAC Name
6a-pentyl-2,3,3a,4,5,6-hexahydrocyclopenta[b]furan
Canonical SMILES
CCCCCC12CCCC1CCO2
InChI Key
MKNDEHITWQEWCT-UHFFFAOYSA-N
Boiling Point
234.7ºC at 760mmHg
Flash Point
81.1ºC
Density
0.93g/cm³
EC Number
304-723-5
Exact Mass
182.16700
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of Hexahydro-6a-pentyl-2H-cyclopenta[b]furan?

The molecular formula is C12H22O.

When was Hexahydro-6a-pentyl-2H-cyclopenta[b]furan created in PubChem?

It was created on August 20, 2009.

What is the molecular weight of Hexahydro-6a-pentyl-2H-cyclopenta[b]furan?

The molecular weight is 182.30 g/mol.

What is the InChIKey of Hexahydro-6a-pentyl-2H-cyclopenta[b]furan?

The InChIKey is MKNDEHITWQEWCT-UHFFFAOYSA-N.

How many hydrogen bond donor counts does Hexahydro-6a-pentyl-2H-cyclopenta[b]furan have?

It has 0 hydrogen bond donor counts.

What is the topological polar surface area of Hexahydro-6a-pentyl-2H-cyclopenta[b]furan?

The topological polar surface area is 9.2 Ų.

How many rotatable bond counts does Hexahydro-6a-pentyl-2H-cyclopenta[b]furan have?

It has 4 rotatable bond counts.

Is Hexahydro-6a-pentyl-2H-cyclopenta[b]furan canonicalized in PubChem?

Yes, it is canonicalized.

What is the formal charge of Hexahydro-6a-pentyl-2H-cyclopenta[b]furan?

The formal charge is 0.

How many defined atom stereocenter count and undefined atom stereocenter count does Hexahydro-6a-pentyl-2H-cyclopenta[b]furan have?

It has 0 defined atom stereocenter count and 2 undefined atom stereocenter count.

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