Structure

1-Acenaphthenol

CAS
6306-07-6
Catalog Number
ACM6306076
Category
Other Products
Molecular Weight
170.21
Molecular Formula
C12H10O

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Specification

Synonyms
Acenaphthene-1-Hydroxy
IUPAC Name
1,2-dihydroacenaphthylen-1-ol
Canonical SMILES
C1C(C2=CC=CC3=C2C1=CC=C3)O
InChI Key
MXUCIEHYJYRTLT-UHFFFAOYSA-N
Boiling Point
369.2ºC at 760 mmHg
Melting Point
145-148ºC(lit.)
Flash Point
129ºC
Density
1.29g/cm³
Appearance
white to cream solid
Complexity
201
Defined Atom Stereocenter Count
0
EC Number
228-618-8
Exact Mass
170.0731
Formal Charge
0
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
13
Hydrogen Bond Acceptor Count
1
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
170.0731
Rotatable Bond Count
0
Safety Description
S24/25
Stability
Stable. Combustible. Incompatible with strong oxidizing agents.
Topological Polar Surface Area
20.2 Ų
WGK Germany
3
XLogP3-AA
2.4
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