CS-1042729
2-Fluoro-2-(isothiazol-5-yl)acetic acid
Manufacturer: ChemScene
CAS Number: 1935916-12-3
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₅H₄FNO₂S
Molecular Weight
161.15
Synonyms
None
SMILES
O=C(O)C(F)C=1SN=CC1
Tpsa
50.19
Logp
1.2383
H Acceptors
3
H Donors
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₄FNO₂S
Molecular Weight: 161.15
Synonyms: None
SMILES: O=C(O)C(F)C=1SN=CC1
Tpsa: 50.19
Logp: 1.2383
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₄FNO₂S
Molecular Weight:
161.15
Synonyms:
None
SMILES:
O=C(O)C(F)C=1SN=CC1
Tpsa:
50.19
Logp:
1.2383
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈BrFO₃S
Molecular Weight: 283.11
Synonyms: None
SMILES: O=S(=O)(F)C1=CC=C(OCC)C(Br)=C1
Tpsa: 43.37
Logp: 2.506
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈BrFO₃S
Molecular Weight:
283.11
Synonyms:
None
SMILES:
O=S(=O)(F)C1=CC=C(OCC)C(Br)=C1
Tpsa:
43.37
Logp:
2.506
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₂O₃S
Molecular Weight: 176.23
Synonyms: None
SMILES: O=C(OC)C(C)C1(O)CSC1
Tpsa: 46.53
Logp: 0.2734
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₂O₃S
Molecular Weight:
176.23
Synonyms:
None
SMILES:
O=C(OC)C(C)C1(O)CSC1
Tpsa:
46.53
Logp:
0.2734
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₈N₂O
Molecular Weight: 158.24
Synonyms: None
SMILES: OC1(CNC(C)CC1)CCN
Tpsa: 58.28
Logp: -0.1618
H Acceptors: 3
H Donors: 3
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₈N₂O
Molecular Weight:
158.24
Synonyms:
None
SMILES:
OC1(CNC(C)CC1)CCN
Tpsa:
58.28
Logp:
-0.1618
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
2