(2,2-Difluorocyclopropyl)methylamine - CAS 847926-81-2

Name: (2,2-Difluorocyclopropyl)methylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB067829
Product Name:	(2,2-Difluorocyclopropyl)methylamine
CAS:	847926-81-2
Synonyms:	2,2-Difluoro-cyclopropanemethanamine; (2,2-Difluorocyclopropyl)methanamine

Technical Data

IUPAC Name:	(2,2-difluorocyclopropyl)methanamine
Description:	(2,2-Difluorocyclopropyl)methylamine is a difluorinated-derivative of Cyclopropylmethylamine (C988695) and is used as a reagent in the synthesis of pyrrolidine derivatives as alternative pathway modulators for the treatment of ophthalmic and other diseases. (2,2-Difluorocyclopropyl)methylamine is also used as the starting material in the synthesis of dihydrodiazepines as protein kinases inhibitors.
Molecular Weight:	107.1
Molecular Formula:	C4H7F2N
Canonical SMILES:	C1C(C1(F)F)CN
InChI:	InChI=1S/C4H7F2N/c5-4(6)1-3(4)2-7/h3H,1-2,7H2
InChI Key:	ISMZEPBEQCSYFX-UHFFFAOYSA-N
References:	Altmann, E., et al. CT Int. Appl. WO 2014002054 A1 20140103. Jan 3, 2014; Damien-Charrier, J., et al. PCT Int. Appl. WO 2007095188 A2 20070823. Aug 23, 2007.

Complexity:	81.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	107.05465555
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	107.05465555
Rotatable Bond Count:	1
Topological Polar Surface Area:	26Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3