CS-1152626
1-Allyl-3-nitro-1H-pyrazole-4-carbonitrile
Manufacturer: ChemScene
CAS Number: 61717-07-5
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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
C₇H₆N₄O₂
Molecular Weight
178.15
Synonyms
None
SMILES
N#CC1=CN(N=C1N(=O)=O)CC=C
Tpsa
84.75
Logp
0.84898
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: C₇H₆N₄O₂
Molecular Weight: 178.15
Synonyms: None
SMILES: N#CC1=CN(N=C1N(=O)=O)CC=C
Tpsa: 84.75
Logp: 0.84898
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:
C₇H₆N₄O₂
Molecular Weight:
178.15
Synonyms:
None
SMILES:
N#CC1=CN(N=C1N(=O)=O)CC=C
Tpsa:
84.75
Logp:
0.84898
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: C₁₇H₂₄BNO₂
Molecular Weight: 285.19
Synonyms: None
SMILES: N1=CC(=CC=C1C2=CCCCC2)B3OC(C)(C)C(O3)(C)C
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₄BNO₂
Molecular Weight:
285.19
Synonyms:
None
SMILES:
N1=CC(=CC=C1C2=CCCCC2)B3OC(C)(C)C(O3)(C)C
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₅F₃N₄S
Molecular Weight: 246.21
Synonyms: None
SMILES: FC(F)(F)C1=CN=CC(=C1)C2=NN=C(S2)N
Tpsa: 64.69
Logp: 2.2011
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:
C₈H₅F₃N₄S
Molecular Weight:
246.21
Synonyms:
None
SMILES:
FC(F)(F)C1=CN=CC(=C1)C2=NN=C(S2)N
Tpsa:
64.69
Logp:
2.2011
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: C₁₃H₁₇BrN₂O₂
Molecular Weight: 313.20
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CC(C2=NC=CC=C2Br)C1
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇BrN₂O₂
Molecular Weight:
313.20
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CC(C2=NC=CC=C2Br)C1
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A