CS-0750662
3-Methyl-4-(piperazin-1-yl)benzonitrile
Manufacturer: ChemScene
CAS Number: 851000-32-3
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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
C₁₂H₁₅N₃
Molecular Weight
201.27
Synonyms
None
SMILES
CC1=CC(=CC=C1N1CCNCC1)C#N
Tpsa
39.06
Logp
1.2763
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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
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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: C₁₂H₁₅N₃
Molecular Weight: 201.27
Synonyms: None
SMILES: CC1=CC(=CC=C1N1CCNCC1)C#N
Tpsa: 39.06
Logp: 1.2763
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:
C₁₂H₁₅N₃
Molecular Weight:
201.27
Synonyms:
None
SMILES:
CC1=CC(=CC=C1N1CCNCC1)C#N
Tpsa:
39.06
Logp:
1.2763
H Acceptors:
3
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: C₁₀H₉I₂NO₃
Molecular Weight: 444.99
Synonyms: None
SMILES: IC1=C2C(C[C@H](NC2)C(O)=O)=CC(I)=C1O
Tpsa: 69.56
Logp: 1.7003
H Acceptors: 3
H Donors: 3
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:
C₁₀H₉I₂NO₃
Molecular Weight:
444.99
Synonyms:
None
SMILES:
IC1=C2C(C[C@H](NC2)C(O)=O)=CC(I)=C1O
Tpsa:
69.56
Logp:
1.7003
H Acceptors:
3
H Donors:
3
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: C₁₀H₇BrO₃
Molecular Weight: 255.06
Synonyms: None
SMILES: CC1=C(Br)C(=O)OC2=CC=C(O)C=C12
Tpsa: 50.44
Logp: 2.56952
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇BrO₃
Molecular Weight:
255.06
Synonyms:
None
SMILES:
CC1=C(Br)C(=O)OC2=CC=C(O)C=C12
Tpsa:
50.44
Logp:
2.56952
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₀N₂
Molecular Weight: 216.32
Synonyms: None
SMILES: C[C@@H](N1C[C@H](N)C2(CC2)C1)C1=CC=CC=C1
Tpsa: 29.26
Logp: 2.1707
H Acceptors: 2
H Donors: 1
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:
C₁₄H₂₀N₂
Molecular Weight:
216.32
Synonyms:
None
SMILES:
C[C@@H](N1C[C@H](N)C2(CC2)C1)C1=CC=CC=C1
Tpsa:
29.26
Logp:
2.1707
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2