(2,2-Difluorocyclopropyl) methanol

CAT: 0127-PC49666-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC49666-01Size:250 mg

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CAS Number

509072-57-5

MDL Number

MFCD06797748

Purity

=95%

Smiles

OCC1CC1(F)F

Chemical Information

(2,2-Difluorocyclopropyl)methanol

CAS Number	509072-57-5
PubChem CID	2761401
IUPAC Name	(2,2-difluorocyclopropyl)methanol
Molecular Formula	C4H6F2O
Molecular Weight	108.09
XLogP	0.6
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	7
Formal Charge	0
Complexity	81

SMILES

C1C(C1(F)F)CO

InChI

InChI=1S/C4H6F2O/c5-4(6)1-3(4)2-7/h3,7H,1-2H2

InChIKey

XOLSMTBBIZDHSG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 509072-57-5

CID: 2761401

Formula: C4H6F2O

MW: 108.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	108.09
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	108.03867113
Monoisotopic Mass	108.03867113
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	81.8
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC520850	(4-Bromophenyl) - (2,2-difluorocyclopropyl) methanone
PC520849	(3-Bromophenyl) - (2,2-difluorocyclopropyl) methanone
PC101884-01	2- (2,2-Difluorocyclopropyl) ethanol
PC1006549-01	(2,2-Difluorocyclopropyl) boronic acid
PC1002057-01	Potassium (2,2-difluorocyclopropyl) trifluoroborate
PC32886-01	(2,2-Difluorocyclopropyl) methanamine hydrochloride
PC400064	4- (2,2-Difluorocyclopropyl) benzenamine
PC400062	3- (2,2-Difluorocyclopropyl) benzenamine
PC520852-01	2- (2,2-Difluorocyclopropyl) acetic acid
PC210077	2-Chloro-5- (2,2-difluorocyclopropyl) pyridine

Catalog	Name
419295-01	(2,2-Difluorocyclopropyl) methanol
TRC-D445440-10G	(2,2-Difluorocyclopropyl)methanol
GDA98007-01	(2,2-Dimethylcyclohexyl) methanol
UGC10111-01	(2,2-difluorocyclobutyl) methanol
NQC76019-01	(2,2-Dimethoxycyclobutyl) methanol
VLC58395-01	(2,2-Difluorocyclohexyl) methanol
ANA70562-01	(2,2-Dimethylcyclopentyl) methanol
TRC-D454393-1G	(2,2-Difluorocyclobutyl)methanol
EMC14536-01	(2,2-Difluorocyclopentyl) methanol
XAA08499-01	(2,2-Dibromocyclopropyl) methanol