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2- (2-Hydroxyethoxy) benzamide

CAT: 0926-NCA90679-02Size: 0.5 gDry Ice: NoHazardous: No
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CAT#:0926-NCA90679-02Size:0.5 g
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CAS Number
63906-79-6
MDL Number
MFCD00025473
Smiles
C1=CC=C (C (=C1) C (=O) N) OCCO
Molecular Formula
C9H11NO3
Molecular Weight
181.19 g/mol
Controlled
No

Chemical Information

Benzamide, o-(beta-hydroxy)ethoxy-
CAS Number63906-79-6
PubChem CID45167
IUPAC Name2-(2-hydroxyethoxy)benzamide
Molecular FormulaC9H11NO3
Molecular Weight181.19
XLogP0.2
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity172
SMILES
C1=CC=C(C(=C1)C(=O)N)OCCO
InChI
InChI=1S/C9H11NO3/c10-9(12)7-3-1-2-4-8(7)13-6-5-11/h1-4,11H,5-6H2,(H2,10,12)
InChIKey
AKHALQJNHJAYRL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzamide, o-(beta-hydroxy)ethoxy-
CAS: 63906-79-6
CID: 45167
Formula: C9H11NO3
MW: 181.19
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight181.19
XLogP30.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass181.07389321
Monoisotopic Mass181.07389321
Topological Polar Surface Area72.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity172
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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ADC-L-1104-formyl-N-(2-(2-hydroxyethoxy)ethyl)benzamide
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