Structure

1-Phenyl-1-propanol

CAS
93-54-9
Catalog Number
ACM93549
Category
Alcohols
Molecular Weight
136.19
Molecular Formula
C9H10O3

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Specification

Synonyms
alpha-Hydroxypropylbenzene
IUPAC Name
1-Phenylpropan-1-ol
Canonical SMILES
CCC(C1=CC=CC=C1)O
InChI
InChI=1S/C9H12O/c1-2-9(10)8-6-4-3-5-7-8/h3-7,9-10H,2H2,1H3
InChI Key
DYUQAZSOFZSPHD-UHFFFAOYSA-N
Boiling Point
217-219 °C
Flash Point
195 °F
Density
0.994 g/mL at 25 °C(lit.)
Solubility
Insoluble in water; soluble in organic solvents, oils
Exact Mass
136.088815002
Hazard Statements
H302
Monoisotopic Mass
136.088815002
Physical State
Liquid
Refractive Index
n20/D 1.521(lit.)
RIDADR
NONH for all modes of transport
Storage Conditions
Dry place,Room Temperature
Symbol
GHS07
Topological Polar Surface Area
20.2 Ų
What is the molecular formula of 1-Phenyl-1-propanol?

The molecular formula of 1-Phenyl-1-propanol is C9H12O.

What is the molecular weight of 1-Phenyl-1-propanol?

The molecular weight of 1-Phenyl-1-propanol is 136.19 g/mol.

Is 1-Phenyl-1-propanol a natural product?

Yes, 1-Phenyl-1-propanol is a natural product found in Solanum lycopersicum.

What is the IUPAC name of 1-Phenyl-1-propanol?

The IUPAC name of 1-Phenyl-1-propanol is 1-phenylpropan-1-ol.

What is the InChIKey of 1-Phenyl-1-propanol?

The InChIKey of 1-Phenyl-1-propanol is DYUQAZSOFZSPHD-UHFFFAOYSA-N.

What is the canonical SMILES of 1-Phenyl-1-propanol?

The canonical SMILES of 1-Phenyl-1-propanol is CCC(C1=CC=CC=C1)O.

What is the CAS number of 1-Phenyl-1-propanol?

The CAS number of 1-Phenyl-1-propanol is 93-54-9.

How many hydrogen bond donor atoms does 1-Phenyl-1-propanol have?

1-Phenyl-1-propanol has 1 hydrogen bond donor atom.

How many rotatable bonds does 1-Phenyl-1-propanol have?

1-Phenyl-1-propanol has 2 rotatable bonds.

What is the topological polar surface area of 1-Phenyl-1-propanol?

The topological polar surface area of 1-Phenyl-1-propanol is 20.2Ų.

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