CS-1063890
Tert-butyl 5-cyano-3-(prop-1-yn-1-yl)-1H-indazole-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2586963-13-3
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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
C₁₆H₁₅N₃O₂
Molecular Weight
281.31
Synonyms
None
SMILES
N#CC=1C=CC2=C(C1)C(C#CC)=NN2C(=O)OC(C)(C)C
Tpsa
67.91
Logp
3.06258
H Acceptors
5
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: C₁₆H₁₅N₃O₂
Molecular Weight: 281.31
Synonyms: None
SMILES: N#CC=1C=CC2=C(C1)C(C#CC)=NN2C(=O)OC(C)(C)C
Tpsa: 67.91
Logp: 3.06258
H Acceptors: 5
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:
C₁₆H₁₅N₃O₂
Molecular Weight:
281.31
Synonyms:
None
SMILES:
N#CC=1C=CC2=C(C1)C(C#CC)=NN2C(=O)OC(C)(C)C
Tpsa:
67.91
Logp:
3.06258
H Acceptors:
5
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: C₁₁H₇FO
Molecular Weight: 174.17
Synonyms: None
SMILES: FC1=CC=C(C#CC)C=2OC=CC12
Tpsa: 13.14
Logp: 2.9433
H Acceptors: 1
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:
C₁₁H₇FO
Molecular Weight:
174.17
Synonyms:
None
SMILES:
FC1=CC=C(C#CC)C=2OC=CC12
Tpsa:
13.14
Logp:
2.9433
H Acceptors:
1
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: C₁₂H₇FO₂
Molecular Weight: 202.18
Synonyms: None
SMILES: O=C(C#CC1=CC=C(F)C=2C=COC12)C
Tpsa: 30.21
Logp: 2.5124
H Acceptors: 2
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:
C₁₂H₇FO₂
Molecular Weight:
202.18
Synonyms:
None
SMILES:
O=C(C#CC1=CC=C(F)C=2C=COC12)C
Tpsa:
30.21
Logp:
2.5124
H Acceptors:
2
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: C₁₄H₁₇N₃O
Molecular Weight: 243.30
Synonyms: None
SMILES: OC(C#CC1=NC=2C=CN(C2N=C1)C)(C)C(C)C
Tpsa: 50.94
Logp: 1.7268
H Acceptors: 4
H Donors: 1
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:
C₁₄H₁₇N₃O
Molecular Weight:
243.30
Synonyms:
None
SMILES:
OC(C#CC1=NC=2C=CN(C2N=C1)C)(C)C(C)C
Tpsa:
50.94
Logp:
1.7268
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1