2,3-Difluoro-4-methylaniline

CAT: 0127-PC302637-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC302637-01Size:1 g

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CAS Number

886503-79-3

MDL Number

MFCD06660321

Purity

=95%

Smiles

Cc1ccc(N)c(F)c1F

Chemical Information

2,3-Difluoro-4-methylaniline

CAS Number	886503-79-3
PubChem CID	17750814
IUPAC Name	2,3-difluoro-4-methylaniline
Molecular Formula	C7H7F2N
Molecular Weight	143.13
XLogP	1.8
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	118

SMILES

CC1=C(C(=C(C=C1)N)F)F

InChI

InChI=1S/C7H7F2N/c1-4-2-3-5(10)7(9)6(4)8/h2-3H,10H2,1H3

InChIKey

HMDHQYKNBZEFTH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 886503-79-3

CID: 17750814

Formula: C7H7F2N

MW: 143.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	143.13
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	143.05465555
Monoisotopic Mass	143.05465555
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	118
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-275253	2,3-Difluoro-4-methylaniline
419669-01	2,3-Difluoro-4-methylaniline hydrochloride
420555-01	2,5-Difluoro-4-methylaniline
EFC02884-01	2,6-Difluoro-4-methylaniline
PIC82576-01	2,4-difluoro-6-methylaniline
sc-277715	4,5-Difluoro-2-methylaniline
TYD-02831-01	3,5-Difluoro-4-Methylaniline
sc-506384	3,4-Difluoro-5-methylaniline
DFC57956-01	2,4-Difluoro-5-methylaniline
sc-283404	2,4-Difluoro-N-methylaniline