CS-0768609
2-Amino-4,5-Dimethyl-1-(3-nitrophenyl)-1H-pyrrole-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 144658-31-1
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₂N₄O₂
Molecular Weight
256.26
Synonyms
None
SMILES
CC1=C(C)C(C#N)=C(N)N1C1=CC(=CC=C1)[N+]([O-])=O
Tpsa
97.88
Logp
2.45622
H Acceptors
5
H Donors
1
Rotatable Bonds
2
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂N₄O₂
Molecular Weight: 256.26
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=CC(=CC=C1)[N+]([O-])=O
Tpsa: 97.88
Logp: 2.45622
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂N₄O₂
Molecular Weight:
256.26
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=CC(=CC=C1)[N+]([O-])=O
Tpsa:
97.88
Logp:
2.45622
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₅N₃O
Molecular Weight: 241.29
Synonyms: None
SMILES: COC1=C(C=CC=C1)N1C(C)=C(C)C(C#N)=C1N
Tpsa: 63.97
Logp: 2.55662
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₅N₃O
Molecular Weight:
241.29
Synonyms:
None
SMILES:
COC1=C(C=CC=C1)N1C(C)=C(C)C(C#N)=C1N
Tpsa:
63.97
Logp:
2.55662
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁Cl₂N₃
Molecular Weight: 280.15
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=CC(Cl)=C(Cl)C=C1
Tpsa: 54.74
Logp: 3.85482
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₁Cl₂N₃
Molecular Weight:
280.15
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=CC(Cl)=C(Cl)C=C1
Tpsa:
54.74
Logp:
3.85482
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₄BrN₃
Molecular Weight: 304.19
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(Br)C=C(C)C=C1
Tpsa: 54.74
Logp: 3.61894
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₁₄BrN₃
Molecular Weight:
304.19
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(Br)C=C(C)C=C1
Tpsa:
54.74
Logp:
3.61894
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1