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6-Benzyloxyindole(CAS No. 15903-94-3)

6-Benzyloxyindole C15H13NO (cas 15903-94-3) Molecular Structure

15903-94-3 Structure

Identification and Related Records

【Name】
6-Benzyloxyindole
【Iupac name】
6-phenylmethoxy-1H-indole
【CAS Registry number】
15903-94-3
【Synonyms】
6-(Phenylmethoxy)indole
【Molecular Formula】
C15H13NO (Products with the same molecular formula)
【Molecular Weight】
223.26982
【Inchi】
InChI=1S/C15H13NO/c1-2-4-12(5-3-1)11-17-14-7-6-13-8-9-16-15(13)10-14/h1-10,16H,11H2
【InChIKey】
FPMICYBCFBLGOZ-UHFFFAOYSA-N
【Canonical SMILES】
C1=CC=C(C=C1)COC2=CC3=C(C=C2)C=CN3
【MOL File】
15903-94-3.mol

Chemical and Physical Properties

【Appearance】
Off-white crystalline powder
【Density】
1.196 g/cm3
【Melting Point】
116-119°C
【Boiling Point】
411.6 °C at 760 mmHg
【Vapour】
1.31E-06mmHg at 25°C
【Refractive Index】
1.669
【Flash Point】
148.9 °C
【Water】
Hardly soluble in water,Soluble in acetone.
【Solubilities】
Hardly soluble in water,Soluble in acetone.
【Color/Form】
yellow to brown
【Storage temp】
2-8°C
【Computed Properties】
Molecular Weight:223.26982 [g/mol]
Molecular Formula:C15H13NO
XLogP3:4.1
H-Bond Donor:1
H-Bond Acceptor:1
Rotatable Bond Count:3
Exact Mass:223.099714
MonoIsotopic Mass:223.099714
Topological Polar Surface Area:25
Heavy Atom Count:17
Formal Charge:0
Complexity:237
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:3
Effective Rotor Count:3
Conformer Sampling RMSD:0.6
CID Conformer Count:29

Safety and Handling

【Hazard Codes】
Xi: Irritant;
【Safety Statements 】
S22;S24/25
【Hazard Note】

Irritant/Keep Cold

Use and Manufacturing

【Usage】

Indole derivative, as antiviral and antitumor agent

Supplier Location

Top Suppliers

Diamond member Hangzhou Dayangchem Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-88938639
Diamond member Wuhan Fortuna Chemical Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:0086-27-59207850
Diamond member shijiazhuang guizheng trade co.,ltd
Country:ChinaChina
Business Type:Trading Company
Telephone:86-312-18103315327
Diamond member Hangzhou J&H Chemical Co., Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-87396430
Diamond member Nanjing Chemlin Chemical Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-25-83697070
Struchem Co Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-512-63009836
Capot Chemical Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-571-85586718
Wuhan Dahua Weiye Pharmaceutical Co.,Ltd
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-27-59887160
Shanghai Hope Chem Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:86-21-61723543
Jinan Haohua Industry Co., Ltd.
Country:ChinaChina
Business Type:Manufacturer
Telephone:0086-531-58773055

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