UL04

CAT: 0013-GTR19196245-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19196245-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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Description

UL04

CAS Number

1801324-41-3

Field of Research

Epigenetics & Chromatin

Smiles

N (C (=O) C1=CC (C (O) =O) =CC=C1) C2=C (OCC) C=CC (C (C) =O) =C2

Molecular Formula

C18H17NO5

Molecular Weight

327.33

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

3-[(5-Acetyl-2-Ethoxyphenyl)carbamoyl]benzoic Acid

CAS Number	1801324-41-3
PubChem CID	91808023
IUPAC Name	3-[(5-acetyl-2-ethoxyphenyl)carbamoyl]benzoic acid
Molecular Formula	C18H17NO5
Molecular Weight	327.3
XLogP	2.3
Topological Polar Surface Area	92.7
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	24
Formal Charge	0
Complexity	478

SMILES

CCOC1=C(C=C(C=C1)C(=O)C)NC(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C18H17NO5/c1-3-24-16-8-7-12(11(2)20)10-15(16)19-17(21)13-5-4-6-14(9-13)18(22)23/h4-10H,3H2,1-2H3,(H,19,21)(H,22,23)

InChIKey

GFOBMGVVDGTGAJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1801324-41-3

CID: 91808023

Formula: C18H17NO5

MW: 327.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	327.3
XLogP3	2.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	327.11067264
Monoisotopic Mass	327.11067264
Topological Polar Surface Area	92.7 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	478
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
MBS5778715	UL04