Structure

1-Propoxy-2-propanol

CAS
1569-01-3
Catalog Number
ACM1569013
Category
Biomaterials
Molecular Weight
118.17g/mol
Molecular Formula
C6H14O2

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Specification

Description
Liquid; WetSolid
Synonyms
PROPYLENE GLYCOL PROPYL ETHER;PROPYLENE GLYCOL MONOPROPYL ETHER;PROPYLENE GLYCOL NORMAL PROPYL ETHER;PNP;1-propoxy-2-propano;1-propoxy-propan-2-ol;2-Propanol, 1-propoxy-;ethermonopropyliquenormaldupropyleneglycol
IUPAC Name
1-propoxypropan-2-ol
Canonical SMILES
CCCOCC(C)O
InChI
InChI=1S/C6H14O2/c1-3-4-8-5-6(2)7/h6-7H,3-5H2,1-2H3
InChI Key
FENFUOGYJVOCRY-UHFFFAOYSA-N
Boiling Point
150.0 °C;150.2 °C
Melting Point
-80.0 °C
Flash Point
48 °C (118 °F) - closed cup
Density
0.8886 g/cu cm at 20 °C
Solubility
8.46 M;Miscible with water
Complexity
45.8
Covalently-Bonded Unit Count
1
Decomposition
When heated to decomposition it emits acrid smoke and irritating fumes.
EC Number
216-372-4
Exact Mass
118.09938g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
1
Heavy Atom Count
8
LogP
log Kow = 0.49 (est)
Monoisotopic Mass
118.09938g/mol
Other Experimental
Henry's Law constant: 3.44X10-7 atm-cu m/mole at 25 °C (est)
Refractive Index
Index of refraction: 1.4130 at 20 °C/D
Rotatable Bond Count
4
Stability
Stable under recommended storage conditions.
Vapor Pressure
1.70 mmHg;2.2125 mm Hg at 25 °C
XLogP3
0.7
What is the molecular formula of 1-Propoxy-2-propanol?

The molecular formula of 1-Propoxy-2-propanol is C6H14O2.

What are some synonyms for 1-Propoxy-2-propanol?

Some synonyms for 1-Propoxy-2-propanol include 1-PROPOXY-2-PROPANOL, 1-Propoxypropan-2-ol, PROPASOL Solvent P, and more.

When was the PubChem CID 15286 created and last modified?

The PubChem CID 15286 was created on March 27, 2005, and last modified on December 2, 2023.

What is the IUPAC Name of 1-Propoxy-2-propanol?

The IUPAC Name of 1-Propoxy-2-propanol is 1-propoxypropan-2-ol.

What is the Canonical SMILES representation of 1-Propoxy-2-propanol?

The Canonical SMILES representation of 1-Propoxy-2-propanol is CCCOCC(C)O.

What is the molecular weight of 1-Propoxy-2-propanol?

The molecular weight of 1-Propoxy-2-propanol is 118.17 g/mol.

What is the InChIKey of 1-Propoxy-2-propanol?

The InChIKey of 1-Propoxy-2-propanol is FENFUOGYJVOCRY-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in 1-Propoxy-2-propanol?

There is 1 hydrogen bond donor count in 1-Propoxy-2-propanol.

How many hydrogen bond acceptor counts are there in 1-Propoxy-2-propanol?

There are 2 hydrogen bond acceptor counts in 1-Propoxy-2-propanol.

Is 1-Propoxy-2-propanol a covalently-bonded unit?

Yes, 1-Propoxy-2-propanol is a covalently-bonded unit.

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