1-Anthracenecarboxylic Acid

CAT: 0572-TRC-A637258-100MGSize: 100 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-A637258-100MGSize:100 mg

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CAS Number

607-42-1

Hazard Statement

Causes skin irritation.

Smiles

OC(=O)c1cccc2cc3ccccc3cc12

Molecular Formula

C15H10O2

Molecular Weight

222.24

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

1-Anthracenecarboxylic Acid

1-anthroic acid is an anthroic acid.

CAS Number	607-42-1
PubChem CID	150789
IUPAC Name	anthracene-1-carboxylic acid
Molecular Formula	C15H10O2
Molecular Weight	222.24
XLogP	4.3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	17
Formal Charge	0
Complexity	299

SMILES

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

InChI

InChI=1S/C15H10O2/c16-15(17)13-7-3-6-12-8-10-4-1-2-5-11(10)9-14(12)13/h1-9H,(H,16,17)

InChIKey

CCFAKBRKTKVJPO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 607-42-1

CID: 150789

Formula: C15H10O2

MW: 222.24

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	222.24
XLogP3	4.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	222.068079557
Monoisotopic Mass	222.068079557
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	299
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

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TRC-A678455-25G	9-Anthracenecarboxylic Acid
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TRC-A697813-50MG	2-Anthracenecarboxylic Acid
TRC-A697813-100MG	2-Anthracenecarboxylic Acid
TRC-A697813-10MG	2-Anthracenecarboxylic Acid
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TRC-B416503-5G	1,1-Cyclobutanedicarboxylic Acid

Alternative Products

Catalog	Name
sc-471442	1-Anthracenecarboxylic Acid
72853037-100g	9-Anthracenecarboxylic acid
sc-471587	2-Anthracenecarboxylic Acid
594840-62-7	9-Anthracenecarboxylic acid, 2- (1,1- dimethylethoxy) -2- oxoethyl este
FDC16642	9,10-Dihydro-4,5-dihydroxy-9,10-dioxo-2-anthracenecarboxylic acid-13C6
40140017-1	Acid Fuchsin (1%) in 1% Acetic Acid
J-030005-01	Polyinosinic acid-polycytidylic acid, homopolymer (1:1)
CS-M-01237	1,1-Cyclobutanedicarboxylic Acid
FD53770-01	1,1-Difluoroacetic acid
OR1009040-01	1,1-Cyclohexanediacetic acid

1-Anthracenecarboxylic Acid

Chemical Information

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