3-Hydroxyphthalic anhydride

CAT: 0926-FH142877-02Size: 50 gDry Ice: NoHazardous: No

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CAT#:0926-FH142877-02Size:50 g

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CAS Number

37418-88-5

Synonyms

4-Hydroxy-1,3-isobenzofurandione;4-Hydroxyisobenzofuran-1,3-dione

MDL Number

MFCD00011557

Smiles

C1=CC2=C (C (=C1) O) C (=O) OC2=O

Molecular Formula

C8H4O4

Molecular Weight

164.11 g/mol

Controlled

Chemical Information

3-Hydroxyphthalic anhydride

used to modify proteins

CAS Number	37418-88-5
PubChem CID	96580
IUPAC Name	4-hydroxy-2-benzofuran-1,3-dione
Molecular Formula	C8H4O4
Molecular Weight	164.11
XLogP	1.5
Topological Polar Surface Area	63.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	235

SMILES

C1=CC2=C(C(=C1)O)C(=O)OC2=O

InChI

InChI=1S/C8H4O4/c9-5-3-1-2-4-6(5)8(11)12-7(4)10/h1-3,9H

InChIKey

CCTOEAMRIIXGDJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 37418-88-5

CID: 96580

Formula: C8H4O4

MW: 164.11

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	164.11
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	164.01095860
Monoisotopic Mass	164.01095860
Topological Polar Surface Area	63.6 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	235
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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FN26343-01	3-Nitrophthalic anhydride
FA63286-01	3-Acetamidophthalic anhydride
EAA16082	3,3-Dimethylglutaric Anhydride
FD42376-01	2,3-Dimethylmaleic anhydride
AAA71639	2,3-Naphthalic Anhydride
GAA81214	2,3-Anthracenedicarboxylic anhydride
FM11816-01	3-Methyl phthalic anhydride

Alternative Products

Catalog	Name
HY-W005592-01	3-Hydroxyphthalic anhydride
sc-483078	4-Hydroxyphthalic anhydride
15025222-25g	2,3-Pyridinedicarboxylic anhydride (Quinolinic anhydride)
HY-W698250	3-Ferrocenylpropionic anhydride
426450-01	3-Methylhexahydrophthalic Anhydride
426155-01	3-Isobutylglutaric Anhydride
288402-01	3-Pyridinecarboxylic Anhydride
GK0653-10g	3-Nitrophthalic anhydride
abx181122-01	3-Methylphthalic anhydride
OR1033806-01	3-Phenylpropanoic anhydride

3-Hydroxyphthalic anhydride

Chemical Information

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