CS-1084131
5-(Tert-butyl)-2-hydroxyisophthalonitrile
Manufacturer: ChemScene
CAS Number: 303994-63-0
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Purity
90%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₂N₂O
Molecular Weight
200.24
Synonyms
None
SMILES
N#CC=1C=C(C=C(C#N)C1O)C(C)(C)C
Tpsa
67.81
Logp
2.43306
H Acceptors
3
H Donors
1
Rotatable Bonds
0
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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: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂N₂O
Molecular Weight: 200.24
Synonyms: None
SMILES: N#CC=1C=C(C=C(C#N)C1O)C(C)(C)C
Tpsa: 67.81
Logp: 2.43306
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂N₂O
Molecular Weight:
200.24
Synonyms:
None
SMILES:
N#CC=1C=C(C=C(C#N)C1O)C(C)(C)C
Tpsa:
67.81
Logp:
2.43306
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁F₃N₂S₂
Molecular Weight: 316.37
Synonyms: None
SMILES: FC(F)(F)C=1N=C(N=C(SC2=CC=C(C=C2)C)C1)SC
Tpsa: 25.78
Logp: 4.67692
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁F₃N₂S₂
Molecular Weight:
316.37
Synonyms:
None
SMILES:
FC(F)(F)C=1N=C(N=C(SC2=CC=C(C=C2)C)C1)SC
Tpsa:
25.78
Logp:
4.67692
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈F₄N₂S₂
Molecular Weight: 320.33
Synonyms: None
SMILES: FC1=CC=C(SC2=NC(=NC(=C2)C(F)(F)F)SC)C=C1
Tpsa: 25.78
Logp: 4.5076
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈F₄N₂S₂
Molecular Weight:
320.33
Synonyms:
None
SMILES:
FC1=CC=C(SC2=NC(=NC(=C2)C(F)(F)F)SC)C=C1
Tpsa:
25.78
Logp:
4.5076
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
3
Purity: 90%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₂ClN₃OS
Molecular Weight: 281.76
Synonyms: None
SMILES: O=C(N)C=1C(=NN(C1SC2=CC=C(Cl)C=C2)C)C
Tpsa: 60.91
Logp: 2.63202
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
90%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₂ClN₃OS
Molecular Weight:
281.76
Synonyms:
None
SMILES:
O=C(N)C=1C(=NN(C1SC2=CC=C(Cl)C=C2)C)C
Tpsa:
60.91
Logp:
2.63202
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3