1-Anthrol

CAT: 0926-WCA03628-01Size: 0.25 gDry Ice: NoHazardous: No

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CAT#:0926-WCA03628-01Size:0.25 g

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CAS Number

71036-28-7

MDL Number

MFCD12027046

Smiles

C1=CC=C2C=C3C (=CC2=C1) C=CC=C3O

Molecular Formula

C14H10O

Molecular Weight

194.23 g/mol

Controlled

Chemical Information

1-Anthracenol

1-anthrol is an anthrol.

CAS Number	71036-28-7
PubChem CID	123077
IUPAC Name	anthracen-1-ol
Molecular Formula	C14H10O
Molecular Weight	194.23
XLogP	4.1
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	15
Formal Charge	0
Complexity	225

SMILES

C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O

InChI

InChI=1S/C14H10O/c15-14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14/h1-9,15H

InChIKey

MUVQKFGNPGZBII-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 71036-28-7

CID: 123077

Formula: C14H10O

MW: 194.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	194.23
XLogP3	4.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	194.073164938
Monoisotopic Mass	194.073164938
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	225
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
WAA49885	(((9,10-dioxo-2-anthryl) amino) methylene) methane-1,1-dicarbonitrile
EAA21952-01	Anthra (2,1-C) (1,2,5) thiadiazole-6,11-dione
CLB27944-01	3- (1-Piperidinyl) -5-[[2- (1-pyrrolidinyl) ethyl]amino]-6H-anthra[1,9-cd]isoxazol-6-one
OF59775-01	1,1,1,1,1-Kestoheptaose
FA17947-01	9-Anthryl methacrylate
MA05165-01	Anthrose
OK59466-01	1,1,1,1-Kestohexose
FA05585-01	Anthrone
IFA69273-01	1-Iodobicyclo[1.1.1]pentane
DFA88480-01	1-Bromobicyclo[1.1.1]pentane

Catalog	Name
297272-01	1,1,1,1,1-Kestoheptaose
N2864-5.1	1,1,1,1-Kestohexaose
112040	1,1,1,1-Kestohexose
410417-01	1,1,1-Trichloromethanesulfonic Acid 1,1'-Anhydride
OR312388	1-Phenylbicyclo[1.1.1]pentane
GTR19217879-01	AMPK-α1β1γ1 activator 1
OR300179	1-Isothiocyanatobicyclo[1.1.1]pentane
OR300174	1-Isocyanatobicyclo[1.1.1]pentane
HY-133623	1,1,1-Tribromoacetone
410424-01	1,1,1-Trifluoroacetone