CS-0880446
3-Methylisothiazole-4,5-dicarboxylic acid
Manufacturer: ChemScene
CAS Number: 67048-61-7
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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
C₆H₅NO₄S
Molecular Weight
187.17
Synonyms
None
SMILES
O=C(C1=C(C(O)=O)SN=C1C)O
Tpsa
87.49
Logp
0.84792
H Acceptors
4
H Donors
2
Rotatable Bonds
2
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: C₆H₅NO₄S
Molecular Weight: 187.17
Synonyms: None
SMILES: O=C(C1=C(C(O)=O)SN=C1C)O
Tpsa: 87.49
Logp: 0.84792
H Acceptors: 4
H Donors: 2
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:
C₆H₅NO₄S
Molecular Weight:
187.17
Synonyms:
None
SMILES:
O=C(C1=C(C(O)=O)SN=C1C)O
Tpsa:
87.49
Logp:
0.84792
H Acceptors:
4
H Donors:
2
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: C₁₀H₁₁NO₂
Molecular Weight: 177.20
Synonyms: None
SMILES: O=C(C1=CC2=C(NC(C)C2)C=C1)O
Tpsa: 49.33
Logp: 1.7413
H Acceptors: 2
H Donors: 2
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:
C₁₀H₁₁NO₂
Molecular Weight:
177.20
Synonyms:
None
SMILES:
O=C(C1=CC2=C(NC(C)C2)C=C1)O
Tpsa:
49.33
Logp:
1.7413
H Acceptors:
2
H Donors:
2
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: C₉H₁₁NO₂S
Molecular Weight: 197.25
Synonyms: None
SMILES: O=C(C1=NC(CCC(C)C2)=C2S1)O
Tpsa: 50.19
Logp: 1.9661
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:
C₉H₁₁NO₂S
Molecular Weight:
197.25
Synonyms:
None
SMILES:
O=C(C1=NC(CCC(C)C2)=C2S1)O
Tpsa:
50.19
Logp:
1.9661
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: C₁₁H₁₃NO₂
Molecular Weight: 191.23
Synonyms: None
SMILES: O=C(C1=CC2=C(NC(C)CC2)C=C1)O
Tpsa: 49.33
Logp: 2.1314
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₃NO₂
Molecular Weight:
191.23
Synonyms:
None
SMILES:
O=C(C1=CC2=C(NC(C)CC2)C=C1)O
Tpsa:
49.33
Logp:
2.1314
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1