2-Amino-5-fluorobenzamide - CAS 63069-49-8

Catalog:	BB031980
Product Name:	2-Amino-5-fluorobenzamide
CAS:	63069-49-8
Synonyms:	2-amino-5-fluorobenzamide; 2-amino-5-fluorobenzamide

Technical Data

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Computed Properties

IUPAC Name:	2-amino-5-fluorobenzamide
Description:	2-Amino-5-fluoro-benzamide is a useful reagent to prepare various quinazolinones including the enantioselective synthesis of fluoro-dihydroquinazolones and -benzooxazinones.
Molecular Weight:	154.14
Molecular Formula:	C7H7FN2O
Canonical SMILES:	C1=CC(=C(C=C1F)C(=O)N)N
InChI:	InChI=1S/C7H7FN2O/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H2,10,11)
InChI Key:	RHJMYIPLYKQZJM-UHFFFAOYSA-N
Boiling Point:	259.286 °C at 760 mmHg
Density:	1.345 g/cm³
MDL:	MFCD03428522
LogP:	1.78830

Publication Number	Title	Priority Date
WO-2021194908-A1	Modified dipeptide cleavases, uses thereof and related kits	20200324
US-2021214701-A1	Modified cleavases, uses thereof and related kits	20190326
CN-110590485-A	FSO2N3Use in the production of azide compounds	20180613
WO-2019238057-A1	Application of fso2n3 in preparation of azide	20180613
KR-102017115-B1	Pharmaceutical composition for use in preventing or treating poly(ADP-ribose)polymerase-1 related diseases containing the same as an active ingredient	20180515

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

Complexity:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	154.05424101
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	154.05424101
Rotatable Bond Count:	1
Topological Polar Surface Area:	69.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.4