N- (3,5-Difluorophenyl) formamide

CAT: 0127-PC901747-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-PC901747-01Size:1 g

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CAS Number

198077-69-9

MDL Number

MFCD00034516

Purity

95%

Smiles

Fc1cc(F)cc(NC=O)c1

Chemical Information

N-(3,5-difluorophenyl)formamide

CAS Number	198077-69-9
PubChem CID	261761
IUPAC Name	N-(3,5-difluorophenyl)formamide
Molecular Formula	C7H5F2NO
Molecular Weight	157.12
XLogP	1.3
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	132

SMILES

C1=C(C=C(C=C1F)F)NC=O

InChI

InChI=1S/C7H5F2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-4H,(H,10,11)

InChIKey

ZYDUAODJWDWHKD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 198077-69-9

CID: 261761

Formula: C7H5F2NO

MW: 157.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	157.12
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	157.03392011
Monoisotopic Mass	157.03392011
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	132
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

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