CS-1063345
(S)-4-(1-Methyl-5-nitro-1H-indazol-7-yl)but-3-yn-2-ol
Manufacturer: ChemScene
CAS Number: 2576227-59-1
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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
C₁₂H₁₁N₃O₃
Molecular Weight
245.23
Synonyms
None
SMILES
C(#C[C@H](C)O)C1=C2C(=CC(N(=O)=O)=C1)C=NN2C
Tpsa
81.19
Logp
1.2138
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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: C₁₂H₁₁N₃O₃
Molecular Weight: 245.23
Synonyms: None
SMILES: C(#C[C@H](C)O)C1=C2C(=CC(N(=O)=O)=C1)C=NN2C
Tpsa: 81.19
Logp: 1.2138
H Acceptors: 5
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:
C₁₂H₁₁N₃O₃
Molecular Weight:
245.23
Synonyms:
None
SMILES:
C(#C[C@H](C)O)C1=C2C(=CC(N(=O)=O)=C1)C=NN2C
Tpsa:
81.19
Logp:
1.2138
H Acceptors:
5
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: C₁₁H₁₆BrN₃
Molecular Weight: 270.17
Synonyms: None
SMILES: BrC1CCCC21NCCC=3C=NN(C32)C
Tpsa: 29.85
Logp: 1.7085
H Acceptors: 3
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:
C₁₁H₁₆BrN₃
Molecular Weight:
270.17
Synonyms:
None
SMILES:
BrC1CCCC21NCCC=3C=NN(C32)C
Tpsa:
29.85
Logp:
1.7085
H Acceptors:
3
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: C₁₃H₁₆N₂O₄
Molecular Weight: 264.28
Synonyms: None
SMILES: O=C(O)C#CC=1C(=NN(C(=O)OC(C)(C)C)C1C)C
Tpsa: 81.42
Logp: 1.71924
H Acceptors: 5
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:
C₁₃H₁₆N₂O₄
Molecular Weight:
264.28
Synonyms:
None
SMILES:
O=C(O)C#CC=1C(=NN(C(=O)OC(C)(C)C)C1C)C
Tpsa:
81.42
Logp:
1.71924
H Acceptors:
5
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: C₁₁H₇FN₂O₂
Molecular Weight: 218.18
Synonyms: None
SMILES: O=C(O)C#CC1=CC=2C=NN(C2C=C1F)C
Tpsa: 55.12
Logp: 1.1485
H Acceptors: 3
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:
C₁₁H₇FN₂O₂
Molecular Weight:
218.18
Synonyms:
None
SMILES:
O=C(O)C#CC1=CC=2C=NN(C2C=C1F)C
Tpsa:
55.12
Logp:
1.1485
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0