CS-1021084
2-Chloro-5,7-dimethyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1599122-86-7
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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
C₁₁H₁₃ClO₂S
Molecular Weight
244.74
Synonyms
None
SMILES
O=C(O)C1=C(Cl)SC2=C1CC(C)CC2C
Tpsa
37.3
Logp
3.7855
H Acceptors
2
H Donors
1
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃ClO₂S
Molecular Weight: 244.74
Synonyms: None
SMILES: O=C(O)C1=C(Cl)SC2=C1CC(C)CC2C
Tpsa: 37.3
Logp: 3.7855
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₃ClO₂S
Molecular Weight:
244.74
Synonyms:
None
SMILES:
O=C(O)C1=C(Cl)SC2=C1CC(C)CC2C
Tpsa:
37.3
Logp:
3.7855
H Acceptors:
2
H Donors:
1
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: C₈H₈FNO₂
Molecular Weight: 169.15
Synonyms: None
SMILES: O=C(O)C(F)C=1C=CN=C(C1)C
Tpsa: 50.19
Logp: 1.48522
H Acceptors: 2
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:
C₈H₈FNO₂
Molecular Weight:
169.15
Synonyms:
None
SMILES:
O=C(O)C(F)C=1C=CN=C(C1)C
Tpsa:
50.19
Logp:
1.48522
H Acceptors:
2
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: C₈H₁₇N₃O₂
Molecular Weight: 187.24
Synonyms: None
SMILES: O=C(NCC)NCC1(O)CNCC1
Tpsa: 73.39
Logp: -0.9701
H Acceptors: 3
H Donors: 4
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:
C₈H₁₇N₃O₂
Molecular Weight:
187.24
Synonyms:
None
SMILES:
O=C(NCC)NCC1(O)CNCC1
Tpsa:
73.39
Logp:
-0.9701
H Acceptors:
3
H Donors:
4
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: C₅H₁₁NO₂S
Molecular Weight: 149.21
Synonyms: None
SMILES: O=S(=O)(N)CCC(=C)C
Tpsa: 60.16
Logp: 0.2411
H Acceptors: 2
H Donors: 1
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:
C₅H₁₁NO₂S
Molecular Weight:
149.21
Synonyms:
None
SMILES:
O=S(=O)(N)CCC(=C)C
Tpsa:
60.16
Logp:
0.2411
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3