CS-0329876
3-Oxo-3-(3-oxopiperazin-1-yl)propanenitrile
Manufacturer: ChemScene
CAS Number: 1016835-36-1
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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
C₇H₉N₃O₂
Molecular Weight
167.17
Synonyms
3-Oxo-3-(3-oxo-piperazin-1-yl)-propionitrile
SMILES
N#CCC(N1CCNC(C1)=O)=O
Tpsa
73.2
Logp
-1.14152
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉N₃O₂
Molecular Weight: 167.17
Synonyms: 3-Oxo-3-(3-oxo-piperazin-1-yl)-propionitrile
SMILES: N#CCC(N1CCNC(C1)=O)=O
Tpsa: 73.2
Logp: -1.14152
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:
C₇H₉N₃O₂
Molecular Weight:
167.17
Synonyms:
3-Oxo-3-(3-oxo-piperazin-1-yl)-propionitrile
SMILES:
N#CCC(N1CCNC(C1)=O)=O
Tpsa:
73.2
Logp:
-1.14152
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: C₁₃H₁₂N₂O₂S
Molecular Weight: 260.31
Synonyms: [4-(2,5-Dimethoxyphenyl)-1,3-thiazol-2-yl]acetonitrile
SMILES: COC1=CC(=C(C=C1)OC)C2=CSC(=N2)CC#N
Tpsa: 55.14
Logp: 2.89338
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂N₂O₂S
Molecular Weight:
260.31
Synonyms:
[4-(2,5-Dimethoxyphenyl)-1,3-thiazol-2-yl]acetonitrile
SMILES:
COC1=CC(=C(C=C1)OC)C2=CSC(=N2)CC#N
Tpsa:
55.14
Logp:
2.89338
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
4
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₁N₃O
Molecular Weight: 189.21
Synonyms: None
SMILES: NC1=NN=C(C2=CC=CC(C)=C2C)O1
Tpsa: 64.94
Logp: 1.93564
H Acceptors: 4
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:
C₁₀H₁₁N₃O
Molecular Weight:
189.21
Synonyms:
None
SMILES:
NC1=NN=C(C2=CC=CC(C)=C2C)O1
Tpsa:
64.94
Logp:
1.93564
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 97% mix TBC as stabilizer
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂N₂
Molecular Weight: 196.25
Synonyms: Benzenamine, 4-[2-(4-pyridinyl)ethenyl]-, (E)-
SMILES: C(=C\C1=CC=NC=C1)/C2=CC=C(C=C2)N
Tpsa: 38.91
Logp: 2.8342
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
97% mix TBC as stabilizer
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₂N₂
Molecular Weight:
196.25
Synonyms:
Benzenamine, 4-[2-(4-pyridinyl)ethenyl]-, (E)-
SMILES:
C(=C\C1=CC=NC=C1)/C2=CC=C(C=C2)N
Tpsa:
38.91
Logp:
2.8342
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2