CS-0768634
2-Amino-1-(4-(Tert-butyl)phenyl)-4,5-dimethyl-1H-pyrrole-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 1096939-99-9
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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
C₁₇H₂₁N₃
Molecular Weight
267.37
Synonyms
None
SMILES
CC1=C(C)C(C#N)=C(N)N1C1=CC=C(C=C1)C(C)(C)C
Tpsa
54.74
Logp
3.84552
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
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: C₁₇H₂₁N₃
Molecular Weight: 267.37
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=CC=C(C=C1)C(C)(C)C
Tpsa: 54.74
Logp: 3.84552
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:
C₁₇H₂₁N₃
Molecular Weight:
267.37
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=CC=C(C=C1)C(C)(C)C
Tpsa:
54.74
Logp:
3.84552
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: C₁₃H₁₂IN₃
Molecular Weight: 337.16
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(I)C=CC=C1
Tpsa: 54.74
Logp: 3.15262
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:
C₁₃H₁₂IN₃
Molecular Weight:
337.16
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(I)C=CC=C1
Tpsa:
54.74
Logp:
3.15262
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: C₁₃H₁₂FN₃
Molecular Weight: 229.25
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(F)C=CC=C1
Tpsa: 54.74
Logp: 2.68712
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:
C₁₃H₁₂FN₃
Molecular Weight:
229.25
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(F)C=CC=C1
Tpsa:
54.74
Logp:
2.68712
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: C₁₃H₁₂ClN₃
Molecular Weight: 245.71
Synonyms: None
SMILES: CC1=C(C)C(C#N)=C(N)N1C1=C(Cl)C=CC=C1
Tpsa: 54.74
Logp: 3.20142
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:
C₁₃H₁₂ClN₃
Molecular Weight:
245.71
Synonyms:
None
SMILES:
CC1=C(C)C(C#N)=C(N)N1C1=C(Cl)C=CC=C1
Tpsa:
54.74
Logp:
3.20142
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1