CS-0996876
tert-Butyl 7-chloro-6-cyano-3-iodo-1H-indole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2750639-88-2
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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
C₁₄H₁₂ClIN₂O₂
Molecular Weight
402.61
Synonyms
None
SMILES
N#CC=1C=CC=2C(I)=CN(C(=O)OC(C)(C)C)C2C1Cl
Tpsa
55.02
Logp
4.55418
H Acceptors
4
H Donors
0
Rotatable Bonds
0
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: C₁₄H₁₂ClIN₂O₂
Molecular Weight: 402.61
Synonyms: None
SMILES: N#CC=1C=CC=2C(I)=CN(C(=O)OC(C)(C)C)C2C1Cl
Tpsa: 55.02
Logp: 4.55418
H Acceptors: 4
H Donors: 0
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:
C₁₄H₁₂ClIN₂O₂
Molecular Weight:
402.61
Synonyms:
None
SMILES:
N#CC=1C=CC=2C(I)=CN(C(=O)OC(C)(C)C)C2C1Cl
Tpsa:
55.02
Logp:
4.55418
H Acceptors:
4
H Donors:
0
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: C₂₁H₃₃BN₂O₅Si
Molecular Weight: 432.39
Synonyms: None
SMILES: O=C(OC)C1=NC2=C(C=C1)C(=CN2COCC[Si](C)(C)C)B3OC(C)(C)C(O3)(C)C
Tpsa: 71.81
Logp: 3.4344
H Acceptors: 7
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₃₃BN₂O₅Si
Molecular Weight:
432.39
Synonyms:
None
SMILES:
O=C(OC)C1=NC2=C(C=C1)C(=CN2COCC[Si](C)(C)C)B3OC(C)(C)C(O3)(C)C
Tpsa:
71.81
Logp:
3.4344
H Acceptors:
7
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₀FNO₄
Molecular Weight: 297.32
Synonyms: None
SMILES: [C@@](CC1=C(F)C=CC=C1)(NC(OC(C)(C)C)=O)(C(O)=O)C
Tpsa: 75.63
Logp: 2.7362
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₀FNO₄
Molecular Weight:
297.32
Synonyms:
None
SMILES:
[C@@](CC1=C(F)C=CC=C1)(NC(OC(C)(C)C)=O)(C(O)=O)C
Tpsa:
75.63
Logp:
2.7362
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀N₂O₄
Molecular Weight: 234.21
Synonyms: None
SMILES: O=C(O)C=1C=CN2N=C(C=C2C1)C(=O)OCC
Tpsa: 80.9
Logp: 1.2092
H Acceptors: 5
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:
C₁₁H₁₀N₂O₄
Molecular Weight:
234.21
Synonyms:
None
SMILES:
O=C(O)C=1C=CN2N=C(C=C2C1)C(=O)OCC
Tpsa:
80.9
Logp:
1.2092
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3