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2-Bromobenzyl mercaptan

CAT: 0024-sc-225238Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-225238Size:1 g
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CAS Number
143888-85-1

Chemical Information

(2-Bromophenyl)methanethiol
CAS Number143888-85-1
PubChem CID2773673
IUPAC Name(2-bromophenyl)methanethiol
Molecular FormulaC7H7BrS
Molecular Weight203.10
XLogP2.7
Topological Polar Surface Area1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity85
SMILES
C1=CC=C(C(=C1)CS)Br
InChI
InChI=1S/C7H7BrS/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2
InChIKey
UJNSDLRPHRMVGZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2-Bromophenyl)methanethiol
CAS: 143888-85-1
CID: 2773673
Formula: C7H7BrS
MW: 203.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight203.10
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass201.94518
Monoisotopic Mass201.94518
Topological Polar Surface Area1 Ų
Heavy Atom Count9
Formal Charge0
Complexity85
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
264088-012-Bromobenzyl mercaptan
PAA09200-012-Methylbenzyl mercaptan
FD362332,4-Dichlorobenzyl mercaptan
D1039-75Dansylamidoethyl Mercaptan (2- (5-Dimethylaminonaphth-1-ylsulfonamido) ethyl Mercaptan)
MBS654110-01Dansylamidoethyl Mercaptan (2-(5-Dimethylaminonaphth-1-ylsulfonamido)ethyl Mercaptan)
TRC-T219520-1G2,4,6-Trimethylbenzyl mercaptan
LKB49829-014-Bromo-2-fluorobenzyl mercaptan
TRC-T219520-2.5G2,4,6-Trimethylbenzyl mercaptan (>90%)
276278-012-[ (5-Fluoresceinyl) aminocarbonyl]ethyl mercaptan
F5006002-[(5-Fluoresceinyl)aminocarbonyl]ethyl Mercaptan

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