CS-1062625
(S)-4-(2-Methyl-6-nitro-2H-indazol-3-yl)but-3-yn-2-ol
Manufacturer: ChemScene
CAS Number: 2562938-21-8
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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(C=C(N(=O)=O)C=C2)=NN1C
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(C=C(N(=O)=O)C=C2)=NN1C
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(C=C(N(=O)=O)C=C2)=NN1C
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: C₁₂H₁₂BrNO
Molecular Weight: 266.13
Synonyms: None
SMILES: BrCCC1=CN=C2C=C(OC)C=CC2=C1
Tpsa: 22.12
Logp: 3.1808
H Acceptors: 2
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:
C₁₂H₁₂BrNO
Molecular Weight:
266.13
Synonyms:
None
SMILES:
BrCCC1=CN=C2C=C(OC)C=CC2=C1
Tpsa:
22.12
Logp:
3.1808
H Acceptors:
2
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: C₁₃H₁₇N
Molecular Weight: 187.28
Synonyms: None
SMILES: C=1C=CC2=C(C1)CC3(NC2(C)C)CC3
Tpsa: 12.03
Logp: 2.6
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:
C₁₃H₁₇N
Molecular Weight:
187.28
Synonyms:
None
SMILES:
C=1C=CC2=C(C1)CC3(NC2(C)C)CC3
Tpsa:
12.03
Logp:
2.6
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: C₈H₇ClF₃N₅
Molecular Weight: 265.62
Synonyms: None
SMILES: ClC1=C2C(N=C(C[C@H](C(F)(F)F)N)N2)=NC=N1
Tpsa: 80.48
Logp: 1.4384
H Acceptors: 4
H Donors: 2
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:
C₈H₇ClF₃N₅
Molecular Weight:
265.62
Synonyms:
None
SMILES:
ClC1=C2C(N=C(C[C@H](C(F)(F)F)N)N2)=NC=N1
Tpsa:
80.48
Logp:
1.4384
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
2