Benzenesulfonic acid,4-nitro-, 2-[(2-hydroxyphenyl)methylene]hydrazide(CAS No. 56395-26-7) CAS NO.56395-26-7

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Keywords

Benzenesulfonic acid,4-nitro-, 2-[(2-hydroxyphenyl)methylene]hydrazide
56395-26-7
98%

Quick Details

ProName: Benzenesulfonic acid,4-nitro-, 2-[(2-h...
CasNo: 56395-26-7
Molecular Formula: C13H11 N3 O5 S
Appearance: Solid
Application: Organic Chemicals
DeliveryTime: According to client's demand quantity
PackAge: as requested
Port: SHANGHAI
ProductionCapacity: 1 Metric Ton/Month
Purity: 99%
Storage: room temperature
Transportation: as requested
LimitNum: 1 Gram

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Details

Identification and Related Records
【Name】
Benzenesulfonic acid,4-nitro-, 2-[(2-hydroxyphenyl)methylene]hydrazide
【CAS Registry number】
56395-26-7
【Synonyms】
Benzenesulfonicacid, 4-nitro-, [(2-hydroxyphenyl)methylene]hydrazide (9CI)
Benzenesulfonicacid, p-nitro-, salicylidenehydrazide (6CI)
NSC 22620
【Molecular Formula】
C13H11 N3 O5 S (Products with the same molecular formula)
【Molecular Weight】
321.3085
【Inchi】
InChI=1/C13H11N3O5S/c17-13-4-2-1-3-10(13)9-14-15-22(20,21)12-7-5-11(6-8-12)16(18)19/h1-9,14-15H/b10-9-
【Canonical SMILES】
C1=CC(=CNNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C=C1
【Isomers smiles】
C1=C/C(=C/NNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])/C(=O)C=C1
Chemical and Physical Properties
【Density】
1.56g/cm3
【Boiling Point】
529.1°C at 760 mmHg
【Refractive Index】
1.692
【Flash Point】
273.8°C
【Computed Properties】
Molecular Weight:321.30854 [g/mol]
Molecular Formula:C13H11N3O5S
XLogP3-AA:2.5
H-Bond Donor:2
H-Bond Acceptor:7
Rotatable Bond Count:4
Tautomer Count:6
Exact Mass:321.041941
MonoIsotopic Mass:321.041941
Topological Polar Surface Area:130
Heavy Atom Count:22
Formal Charge:0
Complexity:632
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:1
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:5
Feature 3D Donor Count:2
Feature 3D Anion Count:1
Feature 3D Ring Count:2
Effective Rotor Count:5
Conformer Sampling RMSD:0.8
CID Conformer Count:28

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