CS-1046751
Methyl 5-ethynyl-4-thiazolecarboxylate
Manufacturer: ChemScene
CAS Number: 912639-71-5
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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
C₇H₅NO₂S
Molecular Weight
167.19
Synonyms
None
SMILES
O=C(C1=C(C#C)SC=N1)OC
Tpsa
39.19
Logp
0.911
H Acceptors
4
H Donors
0
Rotatable Bonds
1
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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: C₇H₅NO₂S
Molecular Weight: 167.19
Synonyms: None
SMILES: O=C(C1=C(C#C)SC=N1)OC
Tpsa: 39.19
Logp: 0.911
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:
C₇H₅NO₂S
Molecular Weight:
167.19
Synonyms:
None
SMILES:
O=C(C1=C(C#C)SC=N1)OC
Tpsa:
39.19
Logp:
0.911
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₃F₂NO₂S
Molecular Weight: 179.14
Synonyms: None
SMILES: O=C(C1=C(C(F)F)SC=N1)O
Tpsa: 50.19
Logp: 1.7789
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:
C₅H₃F₂NO₂S
Molecular Weight:
179.14
Synonyms:
None
SMILES:
O=C(C1=C(C(F)F)SC=N1)O
Tpsa:
50.19
Logp:
1.7789
H Acceptors:
3
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: C₁₂H₁₂BrIN₂O
Molecular Weight: 407.04
Synonyms: None
SMILES: IC1=C(Br)C2=C(N(C3CCCCO3)N=C2)C=C1
Tpsa: 27.05
Logp: 4.1025
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:
C₁₂H₁₂BrIN₂O
Molecular Weight:
407.04
Synonyms:
None
SMILES:
IC1=C(Br)C2=C(N(C3CCCCO3)N=C2)C=C1
Tpsa:
27.05
Logp:
4.1025
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: C₁₅H₁₉BrN₂O₄
Molecular Weight: 371.23
Synonyms: None
SMILES: CN1C2=CC(Br)=CC=C2OC[C@H](C1=O)NC(OC(C)(C)C)=O
Tpsa: 67.87
Logp: 2.6976
H Acceptors: 4
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:
C₁₅H₁₉BrN₂O₄
Molecular Weight:
371.23
Synonyms:
None
SMILES:
CN1C2=CC(Br)=CC=C2OC[C@H](C1=O)NC(OC(C)(C)C)=O
Tpsa:
67.87
Logp:
2.6976
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1