Bromophos-methyl

CAT: 0024-sc-227533Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-227533Size:100 mg

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CAS Number

2104-96-3

Chemical Information

Bromophos

Bromofos is an organic thiophosphate.

CAS Number	2104-96-3
PubChem CID	16422
IUPAC Name	(4-bromo-2,5-dichlorophenoxy)-dimethoxy-sulfanylidene-lambda5-phosphane
Molecular Formula	C8H8BrCl2O3PS
Molecular Weight	366.00
XLogP	5.2
Topological Polar Surface Area	59.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	16
Formal Charge	0
Complexity	276

SMILES

COP(=S)(OC)OC1=CC(=C(C=C1Cl)Br)Cl

InChI

InChI=1S/C8H8BrCl2O3PS/c1-12-15(16,13-2)14-8-4-6(10)5(9)3-7(8)11/h3-4H,1-2H3

InChIKey

NYQDCVLCJXRDSK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2104-96-3

CID: 16422

Formula: C8H8BrCl2O3PS

MW: 366.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	366.00
XLogP3	5.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	363.84922
Monoisotopic Mass	363.84922
Topological Polar Surface Area	59.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	276
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-239430	Bromophos-ethyl
sc-483471	Methyl Acrylamidoglycolate Methyl Ester
sc-484429	Methyl p-methyl-α-chlorophenylacetate
sc-358332	Methyl 4-[ (methylthio) methyl]benzoate
sc-346587	[ (3-bromophenyl) methyl] (methyl) amine
sc-218724	Methyl β-Neuraminic Acid, Methyl Ester
sc-353927	Methyl 4-[ (chlorosulfonyl) methyl]benzoate
sc-353948A	Methyl 4-aminophenyl (methyl) carbamate
sc-250341	Methyl 2-methyl-3-nitrobenzoate
sc-235800	Methyl 5-methyl-2-furoate

Catalog	Name
CS-AZ-00087	Bromophos-methyl
EAA85562-01	Bromophos-methyl-oxon
S-570	Bromophos-Methyl - 1ML
443512-01	Bromophos
443513-01	Bromophos-ethyl
AR-P31425-01	Bromophos-ethy
REPET178N	Pesticide Std Bromophos Methyl Neat - 10MG
S-565	Bromophos-ethyl - 1ML
REPET178	Pesticide Std Bromophos Methyl 1000ug/mL in MeOH - 1ML
S-570-AC	1000 ug/mL Bromophos-Methyl in Acetone Volume: 1mL Ampule - 1ML