Structure

1-Phenoxy-2-propanol

CAS
770-35-4
Catalog Number
ACM770354
Category
Aryl
Molecular Weight
152.19
Molecular Formula
C9H12O2

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Specification

Description
Chemical Properties Colorless liquid;Uses High-boiling solvent, bactericidal agent, fixa- tive for soaps and perfumes, intermediate for plas- ticizers.;
Synonyms
2-Propanol, 1-phenoxy-
Melting Point
11°C
Flash Point
98.304°C
Density
1.063
Appearance
Green liquid
Assay
0.99
Complexity
98
Defined Atom Stereocenter Count
0
Exact Mass
152.0837
Formal Charge
0
Hazard Statements
H302-H319
Heavy Atom Count
11
Hydrogen Bond Acceptor Count
2
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
152.0837
Packaging
25 kg/DRUMS
Refractive Index
1.519
RIDADR
NONH for all modes of transport
Rotatable Bond Count
3
Stability
Stable. Flammable. Incompatible with strong oxidizing agents.
Storage Conditions
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Symbol
GHS07
Topological Polar Surface Area
29.5 Ų
XLogP3-AA
1.7
What is the molecular formula of 1-Phenoxy-2-propanol?

The molecular formula of 1-Phenoxy-2-propanol is C9H12O2.

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

The molecular weight of 1-Phenoxy-2-propanol is 152.19 g/mol.

What is the IUPAC name of 1-Phenoxy-2-propanol?

The IUPAC name of 1-Phenoxy-2-propanol is 1-phenoxypropan-2-ol.

What is the InChI of 1-Phenoxy-2-propanol?

The InChI of 1-Phenoxy-2-propanol is InChI=1S/C9H12O2/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3.

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

The InChIKey of 1-Phenoxy-2-propanol is IBLKWZIFZMJLFL-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Phenoxy-2-propanol?

The canonical SMILES of 1-Phenoxy-2-propanol is CC(COC1=CC=CC=C1)O.

What is the CAS number of 1-Phenoxy-2-propanol?

The CAS number of 1-Phenoxy-2-propanol is 770-35-4.

What is the UNII of 1-Phenoxy-2-propanol?

The UNII of 1-Phenoxy-2-propanol is 87CZY0NY1A.

What is the XLogP3 value of 1-Phenoxy-2-propanol?

The XLogP3 value of 1-Phenoxy-2-propanol is 1.7.

How many hydrogen bond donor and acceptor counts does 1-Phenoxy-2-propanol have?

1-Phenoxy-2-propanol has 1 hydrogen bond donor count and 2 hydrogen bond acceptor counts.

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