CS-0610109
Methyl 4-ethynylbenzo[b]thiophene-2-carboxylate
Manufacturer: ChemScene
CAS Number: 154629-67-1
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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
C₁₂H₈O₂S
Molecular Weight
216.26
Synonyms
Benzo[b]thiophene-2-carboxylic acid, 4-ethynyl-, methyl ester
SMILES
O=C(C1=CC2=C(C#C)C=CC=C2S1)OC
Tpsa
26.3
Logp
2.6692
H Acceptors
3
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: C₁₂H₈O₂S
Molecular Weight: 216.26
Synonyms: Benzo[b]thiophene-2-carboxylic acid, 4-ethynyl-, methyl ester
SMILES: O=C(C1=CC2=C(C#C)C=CC=C2S1)OC
Tpsa: 26.3
Logp: 2.6692
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:
C₁₂H₈O₂S
Molecular Weight:
216.26
Synonyms:
Benzo[b]thiophene-2-carboxylic acid, 4-ethynyl-, methyl ester
SMILES:
O=C(C1=CC2=C(C#C)C=CC=C2S1)OC
Tpsa:
26.3
Logp:
2.6692
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₉BrN₂O₂
Molecular Weight: 327.22
Synonyms: None
SMILES: O=C(O)C1=CC(NCCCN2CCCC2)=CC(Br)=C1
Tpsa: 52.57
Logp: 3.0451
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 6
Purity:
95%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₉BrN₂O₂
Molecular Weight:
327.22
Synonyms:
None
SMILES:
O=C(O)C1=CC(NCCCN2CCCC2)=CC(Br)=C1
Tpsa:
52.57
Logp:
3.0451
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₃NO₂S
Molecular Weight: 153.16
Synonyms: None
SMILES: O=C(C1=NC(C#C)=CS1)O
Tpsa: 50.19
Logp: 0.8226
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:
C₆H₃NO₂S
Molecular Weight:
153.16
Synonyms:
None
SMILES:
O=C(C1=NC(C#C)=CS1)O
Tpsa:
50.19
Logp:
0.8226
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: C₁₂H₉N
Molecular Weight: 167.21
Synonyms: None
SMILES: CC1=NC2=CC=CC=C2C(C#C)=C1
Tpsa: 12.89
Logp: 2.52452
H Acceptors: 1
H Donors: 0
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:
C₁₂H₉N
Molecular Weight:
167.21
Synonyms:
None
SMILES:
CC1=NC2=CC=CC=C2C(C#C)=C1
Tpsa:
12.89
Logp:
2.52452
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0