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Compound FL0135

CAT: 0013-GTR19269722-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19269722-01Size:1 mg
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Description
Compound FL0135, with CAS No. 1211284-11-5, is a fragment molecule that serves as an important scaffold for molecular linking, expansion, and modification. Compound FL0135 provides a structural basis and research tool for the design and screening of novel drug candidates, and is commonly used in drug discovery, drug synthesis, and related research.
CAS Number
1211284-11-5
Purity
97.27% (May vary between batches)
Smiles
Cl.NC1 (COC1) c1ccccc1
Molecular Formula
C9H12ClNO
Molecular Weight
185.651
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-Phenyloxetan-3-amine hydrochloride
CAS Number1211284-11-5
PubChem CID53256980
IUPAC Name3-phenyloxetan-3-amine;hydrochloride
Molecular FormulaC9H12ClNO
Molecular Weight185.65
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity136
SMILES
C1C(CO1)(C2=CC=CC=C2)N.Cl
InChI
InChI=1S/C9H11NO.ClH/c10-9(6-11-7-9)8-4-2-1-3-5-8;/h1-5H,6-7,10H2;1H
InChIKey
RWUQQOGOMYRSSK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Phenyloxetan-3-amine hydrochloride
CAS: 1211284-11-5
CID: 53256980
Formula: C9H12ClNO
MW: 185.65
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight185.65
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass185.0607417
Monoisotopic Mass185.0607417
Topological Polar Surface Area35.3 Ų
Heavy Atom Count12
Formal Charge0
Complexity136
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

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GTR19269739-01Compound FL0180
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GTR19269730-01Compound FL0164

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