CS-0899505
1-Methyl-3-oxo-2,3-dihydro-1H-indazole-6-carbaldehyde
Manufacturer: ChemScene
CAS Number: 1781145-50-3
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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
C₉H₈N₂O₂
Molecular Weight
176.17
Synonyms
None
SMILES
O=CC1=CC(N(C)N2)=C(C=C1)C2=O
Tpsa
54.86
Logp
0.6791
H Acceptors
3
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
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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: C₉H₈N₂O₂
Molecular Weight: 176.17
Synonyms: None
SMILES: O=CC1=CC(N(C)N2)=C(C=C1)C2=O
Tpsa: 54.86
Logp: 0.6791
H Acceptors: 3
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:
C₉H₈N₂O₂
Molecular Weight:
176.17
Synonyms:
None
SMILES:
O=CC1=CC(N(C)N2)=C(C=C1)C2=O
Tpsa:
54.86
Logp:
0.6791
H Acceptors:
3
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: C₅H₉ClN₂OS
Molecular Weight: 180.66
Synonyms: None
SMILES: OCC(N)C1=CN=CS1.Cl
Tpsa: 59.14
Logp: 0.557
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:
C₅H₉ClN₂OS
Molecular Weight:
180.66
Synonyms:
None
SMILES:
OCC(N)C1=CN=CS1.Cl
Tpsa:
59.14
Logp:
0.557
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: C₁₉H₂₄BN₃O₅
Molecular Weight: 385.22
Synonyms: None
SMILES: O=C(C(N1C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2N(C)C1=O)CC4)NC4=O
Tpsa: 91.56
Logp: 0.6169
H Acceptors: 7
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:
C₁₉H₂₄BN₃O₅
Molecular Weight:
385.22
Synonyms:
None
SMILES:
O=C(C(N1C2=CC=CC(B3OC(C)(C)C(C)(C)O3)=C2N(C)C1=O)CC4)NC4=O
Tpsa:
91.56
Logp:
0.6169
H Acceptors:
7
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: C₄₇H₆₄O₁₄S
Molecular Weight: 885.07
Synonyms: B1920
SMILES: C=C1C[C@]2([H])CC[C@@]34O[C@]5([H])[C@@]6([H])[C@](O[C@]7([H])[C@]5([H])O[C@](CC(C[C@@]8([H])[C@@](C[C@@]9([H])O[C@@](C[C@H](C9=C)C)([H])CC[C@]1([H])O2)([H])O[C@@H]([C@@H]8OC)C[C@H](O)COS(=O)(C%10=CC=C(C=C%10)C)=O)=O)([H])CC7)([H])[C@@]([C@@](O6)([H])C4)([H])O3
Tpsa: 163.74
Logp: 5.19322
H Acceptors: 14
H Donors: 1
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:
C₄₇H₆₄O₁₄S
Molecular Weight:
885.07
Synonyms:
B1920
SMILES:
C=C1C[C@]2([H])CC[C@@]34O[C@]5([H])[C@@]6([H])[C@](O[C@]7([H])[C@]5([H])O[C@](CC(C[C@@]8([H])[C@@](C[C@@]9([H])O[C@@](C[C@H](C9=C)C)([H])CC[C@]1([H])O2)([H])O[C@@H]([C@@H]8OC)C[C@H](O)COS(=O)(C%10=CC=C(C=C%10)C)=O)=O)([H])CC7)([H])[C@@]([C@@](O6)([H])C4)([H])O3
Tpsa:
163.74
Logp:
5.19322
H Acceptors:
14
H Donors:
1
Rotatable Bonds:
7