2-cyano-3-[1-[(6-nitrobenzo[1,3]dioxol-5-yl)methyl]pyrrol-2-yl]prop-2-enamide 53413-70-0 CAS NO.53413-70-0

Min.Order: 1 Gram
Payment Terms: L/C,T/T,

Product Details

Keywords

2-cyano-3-[1-[(6-nitrobenzo[1,3]dioxol-5-yl)methyl]pyrrol-2-yl]prop-2-enamide
53413-70-0
C16H12N4O5

Quick Details

ProName: 2-cyano-3-[1-[(6-nitrobenzo[1,3]dioxol...
CasNo: 53413-70-0
Molecular Formula: C16H12N4O5
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: according to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 100 Kilogram/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram
Heavy metal: N/A
Grade: Industrial Grade

Superiority

Our company was built in 2009 with an ISO certificate.In the past 5 years, we have grown up as a famous fine chemicals supplier in China and we had established stable business relationships with Samsung,LG,Merck,Thermo Fisher Scientific and so on.Our main business covers the fields below:

1.Noble Metal Catalysts (Pt.Pd...)

2.Organic Phosphine Ligands (Tert-butyl-phosphine.Cyclohexyl-phosphine...)

3.OLED intermediates (Fluorene,Carbazole,Boric acid...)

4.Customs Synthesis

Our advantage:

1. Higest quality and good package

2.Fast delivery

3.Better payment term

4.Fast response to customer within 6 hours

5.Good business credit in Europe ,US ,Japan ,Korea

Anyway ,if you need any chemicals from China ,Henan Tianfu can help you

Details

Identification and Related Records
【Name】
2-cyano-3-{1-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-pyrrol-2-yl}prop-2-enamide
【CAS Registry number】
53413-70-0
【Synonyms】
AC1L7I1H
2-cyano-3-[1-[(6-nitro-1,3-benzodioxol-5-yl)methyl]pyrrol-2-yl]prop-2-enamide
【Molecular Formula】
C16H12N4O5 (Products with the same molecular formula)
【Molecular Weight】
340.2903
【Inchi】
InChI=1/C16H12N4O5/c17-7-10(16(18)21)4-12-2-1-3-19(12)8-11-5-14-15(25-9-24-14)6-13(11)20(22)23/h1-6H,8-9H2,(H2,18,21)
【Canonical SMILES】
C1OC2=C(O1)C=C(C(=C2)CN3C=CC=C3C=C(C#N)C(=O)N)[N+](=O)[O-]
【MOL File】
53413-70-0.mol
Chemical and Physical Properties
【Density】
1.51g/cm3
【Boiling Point】
620.5°C at 760 mmHg
【Refractive Index】
1.688
【Flash Point】
329.1°C
【Computed Properties】
Molecular Weight:340.29028 [g/mol]
Molecular Formula:C16H12N4O5
XLogP3-AA:1.2
H-Bond Donor:1
H-Bond Acceptor:6
Rotatable Bond Count:4
Tautomer Count:2
Exact Mass:340.08077
MonoIsotopic Mass:340.08077
Topological Polar Surface Area:136
Heavy Atom Count:25
Formal Charge:0
Complexity:622
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:6
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:3
Effective Rotor Count:5.6
Conformer Sampling RMSD:0.8
CID Conformer Count:53

HENAN NEW BLUE CHEMICAL CO.,LTD