(2-Fluorobenzyl)hydrazine - CAS 51859-98-4

Catalog:	BB027630
Product Name:	(2-Fluorobenzyl)hydrazine
CAS:	51859-98-4
Synonyms:	(2-fluorophenyl)methylhydrazine; (2-fluorophenyl)methylhydrazine

Technical Data

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Computed Properties

IUPAC Name:	(2-fluorophenyl)methylhydrazine
Description:	2-Fluorobenzylhydrazine has been used as a reactant for the synthesis of acylamino substituted benzylbenzohydrazide derivatives.
Molecular Weight:	140.16
Molecular Formula:	C7H9FN2
Canonical SMILES:	C1=CC=C(C(=C1)CNN)F
InChI:	InChI=1S/C7H9FN2/c8-7-4-2-1-3-6(7)5-10-9/h1-4,10H,5,9H2
InChI Key:	OOMBRKGIWITBLL-UHFFFAOYSA-N
Boiling Point:	265.8 °C at 760 mmHg
Density:	1.144 g/cm³
MDL:	MFCD07785903
LogP:	1.88020

Publication Number	Title	Priority Date
WO-2019161534-A1	Novel processes and intermediates for preparation of soluble guanylate cyclase stimulators	20180222
EP-3737679-A1	Novel processes and intermediates for the preparation of soluble guanylate cyclase stimulators	20180110
US-2021053962-A1	Novel processes and intermediates for the preparation of soluble guanylate cyclase stimulators	20180110
EP-3481818-A1	Novel processes for preparation of soluble guanylate cyclase stimulators	20160707
EP-3481820-A1	Solid forms of an sgc stimulator	20160707

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	97.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.07497646
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	140.07497646
Rotatable Bond Count:	2
Topological Polar Surface Area:	38 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8