CS-0612684
(E)-3-(2-Ethynylthiazol-4-yl)acrylic acid
Manufacturer: ChemScene
CAS Number: 2786829-48-7
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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
C₈H₅NO₂S
Molecular Weight
179.20
Synonyms
None
SMILES
O=C(O)/C=C/C1=CSC(C#C)=N1
Tpsa
50.19
Logp
1.2222
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅NO₂S
Molecular Weight: 179.20
Synonyms: None
SMILES: O=C(O)/C=C/C1=CSC(C#C)=N1
Tpsa: 50.19
Logp: 1.2222
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:
C₈H₅NO₂S
Molecular Weight:
179.20
Synonyms:
None
SMILES:
O=C(O)/C=C/C1=CSC(C#C)=N1
Tpsa:
50.19
Logp:
1.2222
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: C₁₀H₇BrF₂N₂O
Molecular Weight: 289.08
Synonyms: None
SMILES: O=C(C1=C(F)C(F)=C(Br)C2=C1NC(C)=C2)N
Tpsa: 58.88
Logp: 2.61592
H Acceptors: 1
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:
C₁₀H₇BrF₂N₂O
Molecular Weight:
289.08
Synonyms:
None
SMILES:
O=C(C1=C(F)C(F)=C(Br)C2=C1NC(C)=C2)N
Tpsa:
58.88
Logp:
2.61592
H Acceptors:
1
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: C₈H₁₀N₂O
Molecular Weight: 150.18
Synonyms: None
SMILES: NC1=NC=CC2=C1CC(C)O2
Tpsa: 48.14
Logp: 0.9872
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₀N₂O
Molecular Weight:
150.18
Synonyms:
None
SMILES:
NC1=NC=CC2=C1CC(C)O2
Tpsa:
48.14
Logp:
0.9872
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₈F₃NO₅S
Molecular Weight: 345.34
Synonyms: Methanesulfonic acid, 1,1,1-trifluoro-, (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-1-cyclohexen-1-yl ester
SMILES: O=S(C(F)(F)F)(OC1=C[C@@H](NC(OC(C)(C)C)=O)CCC1)=O
Tpsa: 81.7
Logp: 2.8137
H Acceptors: 5
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:
C₁₂H₁₈F₃NO₅S
Molecular Weight:
345.34
Synonyms:
Methanesulfonic acid, 1,1,1-trifluoro-, (3S)-3-[[(1,1-dimethylethoxy)carbonyl]amino]-1-cyclohexen-1-yl ester
SMILES:
O=S(C(F)(F)F)(OC1=C[C@@H](NC(OC(C)(C)C)=O)CCC1)=O
Tpsa:
81.7
Logp:
2.8137
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3