N- (2-Bromophenyl) methanesulfonamide

CAT: 0926-REA54791-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-REA54791-01Size:250 mg

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CAS Number

116547-91-2

MDL Number

MFCD00585027

Smiles

CS (=O) (=O) NC1=CC=CC=C1Br

Molecular Formula

C7H8BrNO2S

Molecular Weight

250.12 g/mol

Controlled

Chemical Information

N-(2-bromophenyl)methanesulfonamide

CAS Number	116547-91-2
PubChem CID	3629878
IUPAC Name	N-(2-bromophenyl)methanesulfonamide
Molecular Formula	C7H8BrNO2S
Molecular Weight	250.12
XLogP	1.6
Topological Polar Surface Area	54.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	234

SMILES

CS(=O)(=O)NC1=CC=CC=C1Br

InChI

InChI=1S/C7H8BrNO2S/c1-12(10,11)9-7-5-3-2-4-6(7)8/h2-5,9H,1H3

InChIKey

HRLPDILAYHUIIF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 116547-91-2

CID: 3629878

Formula: C7H8BrNO2S

MW: 250.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	250.12
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	248.94591
Monoisotopic Mass	248.94591
Topological Polar Surface Area	54.6 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	234
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
EAA28450-01	N- (4-Bromophenyl) methanesulfonamide
IDA92251	N- (3-Bromophenyl) methanesulfonamide
KKB68165-01	N-[ (3-Bromophenyl) methyl]methanesulfonamide
IDC95358-01	N-{2-[ (3-Bromophenyl) sulfanyl]ethyl}methanesulfonamide
PCA73238-01	(4-Bromophenyl) methanesulfonamide
ULB35404-01	(3-Bromophenyl) methanesulfonamide
EWB10796-01	N- (2-Hydroxypropyl) methanesulfonamide
KEA38393-01	N- (2-Iodoethyl) methanesulfonamide
WAA89659	N- (2-Chloroethyl) methanesulfonamide
FWB62389-01	N- (2-Isothiocyanatoethyl) methanesulfonamide

Catalog	Name
OR310813	(4-Bromophenyl) methanesulfonamide
OR1001174-01	(3-Bromophenyl) methanesulfonamide
sc-235930	N- (4-Bromophenyl) methanesulfonamide
457046-01	N- (3-Bromophenyl) methanesulfonamide
456815-01	N- (2-Amino-4-bromophenyl) methanesulfonamide
TRC-B665946-500MG	N-[(4-Bromophenyl)methyl]methanesulfonamide
OR1071273-01	N- ((3- (4-Bromophenyl) propanoyl) oxy) methanesulfonamide
OR1034976-01	(2-Chlorophenyl) methanesulfonamide
JH401291	N- (2-bromoethyl) methanesulfonamide
OR1061570-01	N- (2-Oxopropyl) methanesulfonamide