CS-0077423
3-Formyl-4,5,6,7-tetrahydrobenzo[b]thiophene-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1252672-30-2
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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
C₁₀H₁₀O₃S
Molecular Weight
210.25
Synonyms
None
SMILES
O=C(C1=C(C=O)C(CCCC2)=C2S1)O
Tpsa
54.37
Logp
2.1376
H Acceptors
3
H Donors
1
Rotatable Bonds
2
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: C₁₀H₁₀O₃S
Molecular Weight: 210.25
Synonyms: None
SMILES: O=C(C1=C(C=O)C(CCCC2)=C2S1)O
Tpsa: 54.37
Logp: 2.1376
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:
C₁₀H₁₀O₃S
Molecular Weight:
210.25
Synonyms:
None
SMILES:
O=C(C1=C(C=O)C(CCCC2)=C2S1)O
Tpsa:
54.37
Logp:
2.1376
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₃FO
Molecular Weight: 228.26
Synonyms: None
SMILES: COC(C=C1)=CC=C1/C=C/C2=C(C=CC=C2)F
Tpsa: 9.23
Logp: 4.0047
H Acceptors: 1
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:
C₁₅H₁₃FO
Molecular Weight:
228.26
Synonyms:
None
SMILES:
COC(C=C1)=CC=C1/C=C/C2=C(C=CC=C2)F
Tpsa:
9.23
Logp:
4.0047
H Acceptors:
1
H Donors:
0
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: C₁₁H₂₁NO₃
Molecular Weight: 215.29
Synonyms: tert-butyl (3S,5R)-3-hydroxy-5-methyl-piperidine-1-carboxylate
SMILES: C[C@@H]1C[C@H](O)CN(C(OC(C)(C)C)=O)C1
Tpsa: 49.77
Logp: 1.6242
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:
C₁₁H₂₁NO₃
Molecular Weight:
215.29
Synonyms:
tert-butyl (3S,5R)-3-hydroxy-5-methyl-piperidine-1-carboxylate
SMILES:
C[C@@H]1C[C@H](O)CN(C(OC(C)(C)C)=O)C1
Tpsa:
49.77
Logp:
1.6242
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: C₆H₅F₃N₂O₂
Molecular Weight: 194.11
Synonyms: 5-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
SMILES: O=C(C1=C(C(F)(F)F)NN=C1C)O
Tpsa: 65.98
Logp: 1.43512
H Acceptors: 2
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:
C₆H₅F₃N₂O₂
Molecular Weight:
194.11
Synonyms:
5-methyl-3-(trifluoromethyl)-1H-pyrazole-4-carboxylic acid
SMILES:
O=C(C1=C(C(F)(F)F)NN=C1C)O
Tpsa:
65.98
Logp:
1.43512
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1