CAS 605-70-9 1,4-Naphthalenedicarboxylic Acid

NAVIGATION

1,4-Naphthalenedicarboxylic Acid

PRICE INQUIRY

Catalog Number

ACM605709

CAS Number

605-70-9

Product Name

1,4-Naphthalenedicarboxylic Acid

Structure

Category

Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand

Synonyms

NAPHTHALENE-1,4-DICARBOXYLIC ACID;1,4-NAPHTHALENEDICARBOXYLIC ACID;1,4-NAPHTHALIC ACID;1,4-NAPHTHALENEDICARBOXYLIC ACID 95+%;Naphthalene-1,4-dicarboxylicacid,98+%;Naphthalin-1,4-dicarbonsure;1,4-naphthalate;4-Naphthalenedicarboxylic acid

IUPAC Name

naphthalene-1,4-dicarboxylic acid

Molecular Weight

216.19

Molecular Formula

C12H8O4

Canonical SMILES

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

InChI

InChI=1S/C12H8O4/c13-11(14)9-5-6-10(12(15)16)8-4-2-1-3-7(8)9/h1-6H,(H,13,14)(H,15,16)

InChI Key

ABMFBCRYHDZLRD-UHFFFAOYSA-N

Boiling Point

490.2±28.0 °C(Predicted)

Melting Point

320 °C

Purity

>95.0%(T)

Density

1.54 g/cm3

Appearance

Light yellow to Yellow to Orange powder to crystal

Storage

Store under inert gas

Complexity

269

Compound Is Canonicalized

Yes

Covalently-Bonded Unit Count

Defined Atom Stereocenter Count

Defined Bond Stereocenter Count

EC Number

210-094-7

Exact Mass

216.04225873g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

Hydrogen Bond Acceptor Count

Hydrogen Bond Donor Count

Isotope Atom Count

MDL Number

MFCD00014312

Monoisotopic Mass

216.04225873g/mol

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Rotatable Bond Count

Signal Word

Warning

Topological Polar Surface Area

74.6Å²

Undefined Atom Stereocenter Count

Undefined Bond Stereocenter Count

XLogP3

2.6

MSDS

Download MSDS

COA