Products for Research Use Only

AA38-3

CAT: 1410-M28641-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1410-M28641-04Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
AA38-3 inhibites three SHs (ABHD6, ABHD11, and FAAH) .
CAS Number
65815-76-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
250.25
Molecular Formula
C12H14N2O4
Notes
Research use only, not for human use.
Receptor
Calmodulin

Chemical Information

4-Nitrophenyl piperidine-1-carboxylate
CAS Number65815-76-1
PubChem CID726751
IUPAC Name(4-nitrophenyl) piperidine-1-carboxylate
Molecular FormulaC12H14N2O4
Molecular Weight250.25
XLogP2.4
Topological Polar Surface Area75.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity302
SMILES
C1CCN(CC1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C12H14N2O4/c15-12(13-8-2-1-3-9-13)18-11-6-4-10(5-7-11)14(16)17/h4-7H,1-3,8-9H2
InChIKey
DHSYPQIMNAYLCG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Nitrophenyl piperidine-1-carboxylate
CAS: 65815-76-1
CID: 726751
Formula: C12H14N2O4
MW: 250.25
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight250.25
XLogP32.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass250.09535693
Monoisotopic Mass250.09535693
Topological Polar Surface Area75.4 Ų
Heavy Atom Count18
Formal Charge0
Complexity302
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