CS-0514424
2-((Difluoromethyl)thio)-3-methylbenzo[d]thiazol-3-ium trifluoromethanesulfonate
Manufacturer: ChemScene
CAS Number: 2450350-44-2
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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
C₁₀H₈F₅NO₃S₃
Molecular Weight
381.36
Synonyms
None
SMILES
O=S([O-])(C(F)(F)F)=O.FC(SC1=[N+](C)C2=C(C=CC=C2)S1)F
Tpsa
61.08
Logp
3.0919
H Acceptors
5
H Donors
0
Rotatable Bonds
2
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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: C₁₀H₈F₅NO₃S₃
Molecular Weight: 381.36
Synonyms: None
SMILES: O=S([O-])(C(F)(F)F)=O.FC(SC1=[N+](C)C2=C(C=CC=C2)S1)F
Tpsa: 61.08
Logp: 3.0919
H Acceptors: 5
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:
C₁₀H₈F₅NO₃S₃
Molecular Weight:
381.36
Synonyms:
None
SMILES:
O=S([O-])(C(F)(F)F)=O.FC(SC1=[N+](C)C2=C(C=CC=C2)S1)F
Tpsa:
61.08
Logp:
3.0919
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₀BNO₄
Molecular Weight: 277.12
Synonyms: 3-Pyridineacetic acid, 5-(4,4,5,5-tetramethyl-1,2-oxaborolan-2-yl)-, methyl ester
SMILES: O=C(OC)CC1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1
Tpsa: 57.65
Logp: 1.0963
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀BNO₄
Molecular Weight:
277.12
Synonyms:
3-Pyridineacetic acid, 5-(4,4,5,5-tetramethyl-1,2-oxaborolan-2-yl)-, methyl ester
SMILES:
O=C(OC)CC1=CC(B2OC(C)(C)C(C)(C)O2)=CN=C1
Tpsa:
57.65
Logp:
1.0963
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: 4°C, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₅NO₂
Molecular Weight: 217.26
Synonyms: Carbamic acid, N-ethynyl-N-phenyl-, 1,1-dimethylethyl ester
SMILES: O=C(OC(C)(C)C)N(C#C)C1=CC=CC=C1
Tpsa: 29.54
Logp: 3.0188
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₅NO₂
Molecular Weight:
217.26
Synonyms:
Carbamic acid, N-ethynyl-N-phenyl-, 1,1-dimethylethyl ester
SMILES:
O=C(OC(C)(C)C)N(C#C)C1=CC=CC=C1
Tpsa:
29.54
Logp:
3.0188
H Acceptors:
2
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: C₁₄H₂₀FNO₂
Molecular Weight: 253.31
Synonyms: None
SMILES: CC(C)(C)OC(N[C@@H](CF)CC1=CC=CC=C1)=O
Tpsa: 38.33
Logp: 3.0919
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₀FNO₂
Molecular Weight:
253.31
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@@H](CF)CC1=CC=CC=C1)=O
Tpsa:
38.33
Logp:
3.0919
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4