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Structure

12-Hydroxydodecanoic Acid

CAS
505-95-3
Catalog Number
ACM505953
Category
Other Products
Molecular Weight
216.32
Molecular Formula
C12H24O3

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Specification

Synonyms
Dodecanoic Acid, 12-Hydroxy-
IUPAC Name
12-hydroxydodecanoic acid
Canonical SMILES
C(CCCCCC(=O)O)CCCCCO
InChI
InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)
InChI Key
ZDHCZVWCTKTBRY-UHFFFAOYSA-N
Boiling Point
359.2 ºC at 760 mmHg
Melting Point
85-88 ºC(lit.)
Flash Point
185.2 ºC
Density
0.988 g/cm3
Appearance
White to off-white powder
Refractive Index
1.467
Safety Description
22-24/25
What is the molecular formula of 12-Hydroxydodecanoic acid?

The molecular formula of 12-Hydroxydodecanoic acid is C12H24O3.

What is the molecular weight of 12-Hydroxydodecanoic acid?

The molecular weight of 12-Hydroxydodecanoic acid is 216.32 g/mol.

What is the IUPAC name of 12-Hydroxydodecanoic acid?

The IUPAC name of 12-Hydroxydodecanoic acid is "12-hydroxydodecanoic acid."

What is the InChIKey of 12-Hydroxydodecanoic acid?

The InChIKey of 12-Hydroxydodecanoic acid is "ZDHCZVWCTKTBRY-UHFFFAOYSA-N."

What is the Canonical SMILES representation of 12-Hydroxydodecanoic acid?

The Canonical SMILES representation of 12-Hydroxydodecanoic acid is "C(CCCCCC(=O)O)CCCCCO."

What is the CAS number of 12-Hydroxydodecanoic acid?

The CAS number of 12-Hydroxydodecanoic acid is 505-95-3.

What is the Computed Property Value of XLogP3 for 12-Hydroxydodecanoic acid?

The XLogP3 Computed Property Value for 12-Hydroxydodecanoic acid is 3.6.

How many hydrogen bond donor counts are there in 12-Hydroxydodecanoic acid?

There are 2 hydrogen bond donor counts in 12-Hydroxydodecanoic acid.

How many hydrogen bond acceptor counts are there in 12-Hydroxydodecanoic acid?

There are 3 hydrogen bond acceptor counts in 12-Hydroxydodecanoic acid.

How many rotatable bond counts are there in 12-Hydroxydodecanoic acid?

There are 11 rotatable bond counts in 12-Hydroxydodecanoic acid.

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