Chlorimuron Impurity 1

CAT: 1596-AR-C07155-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-C07155-02Size:25 Units

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CAS Number

74223-18-0

Molecular Formula

C16H18N4O7S

Molecular Weight

410.40

API Name

Chlorimuron

Chemical Information

Dimethoxy Chlorimuron

CAS Number	74223-18-0
PubChem CID	10549505
IUPAC Name	ethyl 2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate
Molecular Formula	C16H18N4O7S
Molecular Weight	410.4
XLogP	2
Topological Polar Surface Area	154
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	8
Heavy Atom Count	28
Formal Charge	0
Complexity	627

SMILES

CCOC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C16H18N4O7S/c1-4-27-14(21)10-7-5-6-8-11(10)28(23,24)20-16(22)19-15-17-12(25-2)9-13(18-15)26-3/h5-9H,4H2,1-3H3,(H2,17,18,19,20,22)

InChIKey

LOTWAFIVDZLUEI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 74223-18-0

CID: 10549505

Formula: C16H18N4O7S

MW: 410.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	410.4
XLogP3	2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	8
Exact Mass	410.08962010
Monoisotopic Mass	410.08962010
Topological Polar Surface Area	154 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	627
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
AR-C07156-01	Chlorimuron Impurity 2
AR-C07158-01	Chlorimuron
AR-C07157-01	N-Nitroso Chlorimuron
AR-B01168-01	Benidipine Impurity 5 (Nifedipine Impurity 1)
AR-N01491-01	Nifedipine Impurity 1 (Benidipine Impurity 5)
AR-E10592-01	MTBE Impurity 1 and MTBE Impurity 2
AR-L07287-01	Limonene Impurity 1
AR-L01665-01	Limaprost Impurity 1
AR-L01433-01	Leucoson Impurity 1
AR-L06266-01	Letermovir Impurity 1

Catalog	Name
RM-C531805-01	Chlorimuron-Ethyl
TRC-D434021-100MG	Dichloro Chlorimuron
S-3927	Chlorimuron - 1ML
C109-10MG	Chlorimuron ethyl
TRC-D468350-100MG	Dimethoxy Chlorimuron
TRC-C371274-2.5MG	Chlorimuron-ethyl-d5
HY-W040262R-01	Chlorimuron-ethyl (Standard)
DAG-WT835B	Chlorimuron-ethyl [BSA]
DAG-WT835O	Chlorimuron-ethyl [OVA]
LCS-3927	1000 ug/mL Chlorimuron-ethyl in HPLC Acetonitrile