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N-(2-hydroxyethyl)benzamide

CAT: 0572-TRC-C239770-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-C239770-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
18838-10-3
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
OCCNC(=O)c1ccccc1
Molecular Formula
C9H11NO2
Molecular Weight
165.18
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

2-Benzamidoethanol

structure in first source

CAS Number18838-10-3
PubChem CID569526
IUPAC NameN-(2-hydroxyethyl)benzamide
Molecular FormulaC9H11NO2
Molecular Weight165.19
XLogP0.3
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count12
Formal Charge0
Complexity141
SMILES
C1=CC=C(C=C1)C(=O)NCCO
InChI
InChI=1S/C9H11NO2/c11-7-6-10-9(12)8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,10,12)
InChIKey
ZKSYUNLBFSOENV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Benzamidoethanol
CAS: 18838-10-3
CID: 569526
Formula: C9H11NO2
MW: 165.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight165.19
XLogP30.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass165.078978594
Monoisotopic Mass165.078978594
Topological Polar Surface Area49.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity141
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