CS-0768578
2-Amino-1-(3,4-Dimethoxyphenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 1096940-02-1
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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
C₁₅H₁₇N₃O₂
Molecular Weight
271.31
Synonyms
None
SMILES
COC1=C(OC)C=C(C=C1)N1C(C)=C(C)C(C#N)=C1N
Tpsa
73.2
Logp
2.56522
H Acceptors
5
H Donors
1
Rotatable Bonds
3
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: C₁₅H₁₇N₃O₂
Molecular Weight: 271.31
Synonyms: None
SMILES: COC1=C(OC)C=C(C=C1)N1C(C)=C(C)C(C#N)=C1N
Tpsa: 73.2
Logp: 2.56522
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₇N₃O₂
Molecular Weight:
271.31
Synonyms:
None
SMILES:
COC1=C(OC)C=C(C=C1)N1C(C)=C(C)C(C#N)=C1N
Tpsa:
73.2
Logp:
2.56522
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₀BrN₃O₂S
Molecular Weight: 388.24
Synonyms: None
SMILES: BrC1=CN(C2=NC=CC=C12)S(=O)(=O)C1=C2N=CC=CC2=CC=C1
Tpsa: 64.85
Logp: 3.584
H Acceptors: 5
H Donors: 0
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:
C₁₆H₁₀BrN₃O₂S
Molecular Weight:
388.24
Synonyms:
None
SMILES:
BrC1=CN(C2=NC=CC=C12)S(=O)(=O)C1=C2N=CC=CC2=CC=C1
Tpsa:
64.85
Logp:
3.584
H Acceptors:
5
H Donors:
0
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: C₁₃H₁₀F₃N₃
Molecular Weight: 265.23
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(F)C(F)=C(F)C=C1
Tpsa: 54.74
Logp: 2.96532
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:
C₁₃H₁₀F₃N₃
Molecular Weight:
265.23
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(F)C(F)=C(F)C=C1
Tpsa:
54.74
Logp:
2.96532
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: C₁₃H₁₀Cl₃N₃
Molecular Weight: 314.60
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(Cl)C=C(Cl)C=C1Cl
Tpsa: 54.74
Logp: 4.50822
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:
C₁₃H₁₀Cl₃N₃
Molecular Weight:
314.60
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(Cl)C=C(Cl)C=C1Cl
Tpsa:
54.74
Logp:
4.50822
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1