CS-1171546
1-Isopropyl-3-nitro-1H-pyrazole-4-carbaldehyde
Manufacturer: ChemScene
CAS Number: 3044099-13-7
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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
C₇H₉N₃O₃
Molecular Weight
183.16
Synonyms
None
SMILES
O=CC1=CN(C(C)C)N=C1[N+]([O-])=O
Tpsa
78.03
Logp
1.1847
H Acceptors
5
H Donors
0
Rotatable Bonds
3
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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: C₇H₉N₃O₃
Molecular Weight: 183.16
Synonyms: None
SMILES: O=CC1=CN(C(C)C)N=C1[N+]([O-])=O
Tpsa: 78.03
Logp: 1.1847
H Acceptors: 5
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:
C₇H₉N₃O₃
Molecular Weight:
183.16
Synonyms:
None
SMILES:
O=CC1=CN(C(C)C)N=C1[N+]([O-])=O
Tpsa:
78.03
Logp:
1.1847
H Acceptors:
5
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: C₁₀H₁₇N₃O₃
Molecular Weight: 227.26
Synonyms: None
SMILES: O=C(NC1=NN(C)C=C1CO)OC(C)(C)C
Tpsa: 76.38
Logp: 1.2594
H Acceptors: 5
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:
C₁₀H₁₇N₃O₃
Molecular Weight:
227.26
Synonyms:
None
SMILES:
O=C(NC1=NN(C)C=C1CO)OC(C)(C)C
Tpsa:
76.38
Logp:
1.2594
H Acceptors:
5
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: C₁₁H₁₅BrClNO₂
Molecular Weight: 308.60
Synonyms: None
SMILES: O=C(OCC)C[C@H](N)C1=CC=CC(Br)=C1.[H]Cl
Tpsa: 52.32
Logp: 2.8239
H Acceptors: 3
H Donors: 1
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:
C₁₁H₁₅BrClNO₂
Molecular Weight:
308.60
Synonyms:
None
SMILES:
O=C(OCC)C[C@H](N)C1=CC=CC(Br)=C1.[H]Cl
Tpsa:
52.32
Logp:
2.8239
H Acceptors:
3
H Donors:
1
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: C₇H₆ClF₂NO
Molecular Weight: 193.58
Synonyms: None
SMILES: FC(F)COC1=CC=CN=C1Cl
Tpsa: 22.12
Logp: 2.3789
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:
C₇H₆ClF₂NO
Molecular Weight:
193.58
Synonyms:
None
SMILES:
FC(F)COC1=CC=CN=C1Cl
Tpsa:
22.12
Logp:
2.3789
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
3