4-Cyanophenylhydrazine hydrochloride - CAS 2863-98-1

Name: 4-Cyanophenylhydrazine hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB019897
Product Name:	4-Cyanophenylhydrazine hydrochloride
CAS:	2863-98-1
Synonyms:	4-hydrazinylbenzonitrile;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-hydrazinylbenzonitrile;hydrochloride
Description:	4-Cyanophenylhydrazine hydrochloride (CAS# 2863-98-1) is a compound useful in organic synthesis.
Molecular Weight:	169.61
Molecular Formula:	C7H8ClN3
Canonical SMILES:	C1=CC(=CC=C1C#N)NN.Cl
InChI:	InChI=1S/C7H7N3.ClH/c8-5-6-1-3-7(10-9)4-2-6;/h1-4,10H,9H2;1H
InChI Key:	UXDLLFIRCVPPQP-UHFFFAOYSA-N
Boiling Point:	325.9 °C at 760 mmHg
Melting Point:	241-244 °C (dec.)
Purity:	> 98 %
Density:	1.19 g/cm³
Appearance:	Pale orange to brown powder
Storage:	Refrigerator
MDL:	MFCD00673994
LogP:	2.41918

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Related Functional Groups

Nitrogen Compounds

[1243387-55-4]C10H8F3NO3
1-Cyclopropoxy-3-nitro-5-(trifluoromethyl)benzene
[78056-67-4]C14H18N2
2-(1-Benzyl-4-piperidyl)acetonitrile
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[13021-14-2]C10H15N
2,4,6-Trimethyl-N-methylaniline
[5724-76-5]C7H9NO4
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[351-28-0]C8H8FNO
3'-Fluoroacetanilide

GHS Hazard Statement:	H302 (95.92%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021013712-A1	Polyaromatic urea derivatives and their use in the treatment of muscle diseases	20190719
US-2020024224-A1	Antifungal compounds and methods of forming the same	20180717
WO-2020012427-A1	Compounds and compositions for the treatment of cystic fibrosis	20180713
EP-3820867-A1	Compounds and compositions for the treatment of cystic fibrosis	20180713
WO-2019243964-A1	Pyrazole derivatives as malt1 inhibitors	20180618

Complexity:	138
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.0406750
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	169.0406750
Rotatable Bond Count:	1
Topological Polar Surface Area:	61.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0