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Propyl 3-hydroxycarbanilate

CAT: 0931-T34157-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T34157-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13683-91-5
Target
Others
Related Pathways
Others
Bioactivity
Propyl 3-hydroxycarbanilate is a bioactive chemical.
Smiles
O=C(OCCC)NC=1C=CC=C(O)C1
Molecular Formula
C10H13NO3
Molecular Weight
195.22
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Propyl 3-hydroxycarbanilate
CAS Number13683-91-5
PubChem CID26182
IUPAC Namepropyl N-(3-hydroxyphenyl)carbamate
Molecular FormulaC10H13NO3
Molecular Weight195.21
XLogP2.4
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity184
SMILES
CCCOC(=O)NC1=CC(=CC=C1)O
InChI
InChI=1S/C10H13NO3/c1-2-6-14-10(13)11-8-4-3-5-9(12)7-8/h3-5,7,12H,2,6H2,1H3,(H,11,13)
InChIKey
CNEBLWJNTBZOPL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propyl 3-hydroxycarbanilate
CAS: 13683-91-5
CID: 26182
Formula: C10H13NO3
MW: 195.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight195.21
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass195.08954328
Monoisotopic Mass195.08954328
Topological Polar Surface Area58.6 Ų
Heavy Atom Count14
Formal Charge0
Complexity184
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