CS-0609487
tert-Butyl 2-(4-amino-2-cyanophenyl)acetate
Manufacturer: ChemScene
CAS Number: 1616596-32-7
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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
C₁₃H₁₆N₂O₂
Molecular Weight
232.28
Synonyms
None
SMILES
O=C(OC(C)(C)C)CC1=CC=C(N)C=C1C#N
Tpsa
76.11
Logp
2.02468
H Acceptors
4
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: C₁₃H₁₆N₂O₂
Molecular Weight: 232.28
Synonyms: None
SMILES: O=C(OC(C)(C)C)CC1=CC=C(N)C=C1C#N
Tpsa: 76.11
Logp: 2.02468
H Acceptors: 4
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:
C₁₃H₁₆N₂O₂
Molecular Weight:
232.28
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CC1=CC=C(N)C=C1C#N
Tpsa:
76.11
Logp:
2.02468
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: 4°C, protect from light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₄BrIN₂
Molecular Weight: 322.93
Synonyms: 6-Bromo-4-iodobenzimidazole
SMILES: BrC1=CC2=C(N=CN2)C(I)=C1
Tpsa: 28.68
Logp: 2.93
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C, protect from light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₄BrIN₂
Molecular Weight:
322.93
Synonyms:
6-Bromo-4-iodobenzimidazole
SMILES:
BrC1=CC2=C(N=CN2)C(I)=C1
Tpsa:
28.68
Logp:
2.93
H Acceptors:
1
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: C₁₂H₂₄O₃Si
Molecular Weight: 244.40
Synonyms: None
SMILES: O=C([C@H]1C[C@@](C)(O[Si](C)(C(C)(C)C)C)C1)O
Tpsa: 46.53
Logp: 3.2615
H Acceptors: 2
H Donors: 1
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:
C₁₂H₂₄O₃Si
Molecular Weight:
244.40
Synonyms:
None
SMILES:
O=C([C@H]1C[C@@](C)(O[Si](C)(C(C)(C)C)C)C1)O
Tpsa:
46.53
Logp:
3.2615
H Acceptors:
2
H Donors:
1
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: C₁₃H₁₆FNO₂
Molecular Weight: 237.27
Synonyms: None
SMILES: O=C(OC)[C@H]1N(CC2=CC=CC=C2)C[C@@H](F)C1
Tpsa: 29.54
Logp: 1.772
H Acceptors: 3
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:
C₁₃H₁₆FNO₂
Molecular Weight:
237.27
Synonyms:
None
SMILES:
O=C(OC)[C@H]1N(CC2=CC=CC=C2)C[C@@H](F)C1
Tpsa:
29.54
Logp:
1.772
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3