CS-0639236
1-(3-Chloro-4-isothiazolyl)ethanone
Manufacturer: ChemScene
CAS Number: 2643340-78-5
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₅H₄ClNOS
Molecular Weight
161.61
Synonyms
None
SMILES
CC(C1=CSN=C1Cl)=O
Tpsa
29.96
Logp
1.9991
H Acceptors
3
H Donors
0
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₄ClNOS
Molecular Weight: 161.61
Synonyms: None
SMILES: CC(C1=CSN=C1Cl)=O
Tpsa: 29.96
Logp: 1.9991
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₄ClNOS
Molecular Weight:
161.61
Synonyms:
None
SMILES:
CC(C1=CSN=C1Cl)=O
Tpsa:
29.96
Logp:
1.9991
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₈BrNO
Molecular Weight: 202.05
Synonyms: None
SMILES: BrCC1=NOC(C2CC2)=C1
Tpsa: 26.03
Logp: 2.4469
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₈BrNO
Molecular Weight:
202.05
Synonyms:
None
SMILES:
BrCC1=NOC(C2CC2)=C1
Tpsa:
26.03
Logp:
2.4469
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄F₂N₂O₂S
Molecular Weight: 218.18
Synonyms: None
SMILES: O=S(C1=C(F)C=C(C#N)C=C1F)(N)=O
Tpsa: 83.95
Logp: 0.48388
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄F₂N₂O₂S
Molecular Weight:
218.18
Synonyms:
None
SMILES:
O=S(C1=C(F)C=C(C#N)C=C1F)(N)=O
Tpsa:
83.95
Logp:
0.48388
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₈BrF₂NO₂
Molecular Weight: 280.07
Synonyms: None
SMILES: O=C(OCC)NC1=CC=C(F)C(Br)=C1F
Tpsa: 38.33
Logp: 3.2957
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₈BrF₂NO₂
Molecular Weight:
280.07
Synonyms:
None
SMILES:
O=C(OCC)NC1=CC=C(F)C(Br)=C1F
Tpsa:
38.33
Logp:
3.2957
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2