CS-1072416
2-Amino-3-cyano-4,7-dimethyl-4,5,6,7-tetrahydrobenzo[b]thiophene-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2749964-00-7
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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
C₁₂H₁₄N₂O₂S
Molecular Weight
250.32
Synonyms
None
SMILES
N#CC1=C(SC2=C1C(C(=O)O)(C)CCC2C)N
Tpsa
87.11
Logp
2.44158
H Acceptors
4
H Donors
2
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: C₁₂H₁₄N₂O₂S
Molecular Weight: 250.32
Synonyms: None
SMILES: N#CC1=C(SC2=C1C(C(=O)O)(C)CCC2C)N
Tpsa: 87.11
Logp: 2.44158
H Acceptors: 4
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:
C₁₂H₁₄N₂O₂S
Molecular Weight:
250.32
Synonyms:
None
SMILES:
N#CC1=C(SC2=C1C(C(=O)O)(C)CCC2C)N
Tpsa:
87.11
Logp:
2.44158
H Acceptors:
4
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: C₁₄H₁₈N₂O₂S
Molecular Weight: 278.37
Synonyms: None
SMILES: N#CC1=C(SC2=C1C(C(=O)OCC)(C)CCC2C)N
Tpsa: 76.11
Logp: 2.92008
H Acceptors: 5
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:
C₁₄H₁₈N₂O₂S
Molecular Weight:
278.37
Synonyms:
None
SMILES:
N#CC1=C(SC2=C1C(C(=O)OCC)(C)CCC2C)N
Tpsa:
76.11
Logp:
2.92008
H Acceptors:
5
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: C₁₂H₂₃NO₅S
Molecular Weight: 293.38
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC(OS(=O)(=O)C)CC1(C)C
Tpsa: 72.91
Logp: 1.7506
H Acceptors: 5
H Donors: 0
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:
C₁₂H₂₃NO₅S
Molecular Weight:
293.38
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC(OS(=O)(=O)C)CC1(C)C
Tpsa:
72.91
Logp:
1.7506
H Acceptors:
5
H Donors:
0
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: C₁₁H₆BrFO
Molecular Weight: 253.07
Synonyms: None
SMILES: O=CC1=CC=CC=2C(F)=CC=C(Br)C12
Tpsa: 17.07
Logp: 3.5539
H Acceptors: 1
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:
C₁₁H₆BrFO
Molecular Weight:
253.07
Synonyms:
None
SMILES:
O=CC1=CC=CC=2C(F)=CC=C(Br)C12
Tpsa:
17.07
Logp:
3.5539
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1