CS-0580053
Methyl 4-amino-3-(4-bromophenyl)isothiazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 82424-60-0
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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
C₁₁H₉BrN₂O₂S
Molecular Weight
313.17
Synonyms
5-Isothiazolecarboxylic acid, 4-amino-3-(4-bromophenyl)-, methyl ester
SMILES
O=C(C1=C(N)C(C2=CC=C(Br)C=C2)=NS1)OC
Tpsa
65.21
Logp
2.9414
H Acceptors
5
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 82424-60-0 | methyl 4-amino-3-(4-bromophenyl)isothiazole-5-carboxylate | A2B Chem | -- |
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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: C₁₁H₉BrN₂O₂S
Molecular Weight: 313.17
Synonyms: 5-Isothiazolecarboxylic acid, 4-amino-3-(4-bromophenyl)-, methyl ester
SMILES: O=C(C1=C(N)C(C2=CC=C(Br)C=C2)=NS1)OC
Tpsa: 65.21
Logp: 2.9414
H Acceptors: 5
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:
C₁₁H₉BrN₂O₂S
Molecular Weight:
313.17
Synonyms:
5-Isothiazolecarboxylic acid, 4-amino-3-(4-bromophenyl)-, methyl ester
SMILES:
O=C(C1=C(N)C(C2=CC=C(Br)C=C2)=NS1)OC
Tpsa:
65.21
Logp:
2.9414
H Acceptors:
5
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: C₁₆H₂₅NO
Molecular Weight: 247.38
Synonyms: None
SMILES: O=CC1=CC=C(CN(CCCC)CCCC)C=C1
Tpsa: 20.31
Logp: 3.9013
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 9
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₂₅NO
Molecular Weight:
247.38
Synonyms:
None
SMILES:
O=CC1=CC=C(CN(CCCC)CCCC)C=C1
Tpsa:
20.31
Logp:
3.9013
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆N₂S₂
Molecular Weight: 170.26
Synonyms: 5-METHYL-3-(METHYLSULFANYL)-4-ISOTHIAZOLECARBONITRILE
SMILES: CC1=C(C(=NS1)SC)C#N
Tpsa: 36.68
Logp: 2.0451
H Acceptors: 4
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:
C₆H₆N₂S₂
Molecular Weight:
170.26
Synonyms:
5-METHYL-3-(METHYLSULFANYL)-4-ISOTHIAZOLECARBONITRILE
SMILES:
CC1=C(C(=NS1)SC)C#N
Tpsa:
36.68
Logp:
2.0451
H Acceptors:
4
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: C₁₅H₂₅NO₃
Molecular Weight: 267.36
Synonyms: 2-{[cyclohexyl(methyl)amino]carbonyl}cyclohexanecarboxylic acid
SMILES: O=C(C1C(C(N(C2CCCCC2)C)=O)CCCC1)O
Tpsa: 57.61
Logp: 2.6685
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₅NO₃
Molecular Weight:
267.36
Synonyms:
2-{[cyclohexyl(methyl)amino]carbonyl}cyclohexanecarboxylic acid
SMILES:
O=C(C1C(C(N(C2CCCCC2)C)=O)CCCC1)O
Tpsa:
57.61
Logp:
2.6685
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3