CS-0365624
3-(4-(4-Chlorophenyl)piperazin-1-yl)-3-oxopropanenitrile
Manufacturer: ChemScene
CAS Number: 544435-68-9
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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
C₁₃H₁₄ClN₃O
Molecular Weight
263.72
Synonyms
None
SMILES
C1=C(C=CC(=C1)N2CCN(CC2)C(=O)CC#N)Cl
Tpsa
47.34
Logp
1.90228
H Acceptors
3
H Donors
0
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₄ClN₃O
Molecular Weight: 263.72
Synonyms: None
SMILES: C1=C(C=CC(=C1)N2CCN(CC2)C(=O)CC#N)Cl
Tpsa: 47.34
Logp: 1.90228
H Acceptors: 3
H Donors: 0
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:
C₁₃H₁₄ClN₃O
Molecular Weight:
263.72
Synonyms:
None
SMILES:
C1=C(C=CC(=C1)N2CCN(CC2)C(=O)CC#N)Cl
Tpsa:
47.34
Logp:
1.90228
H Acceptors:
3
H Donors:
0
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: C₁₆H₁₂Br₂O₃
Molecular Weight: 412.07
Synonyms: 2-Propenoic acid, 3-[3,5-dibromo-4-(phenylmethoxy)phenyl]
SMILES: O=C(O)C=CC1=CC(Br)=C(OCC2=CC=CC=C2)C(Br)=C1
Tpsa: 46.53
Logp: 4.8884
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₆H₁₂Br₂O₃
Molecular Weight:
412.07
Synonyms:
2-Propenoic acid, 3-[3,5-dibromo-4-(phenylmethoxy)phenyl]
SMILES:
O=C(O)C=CC1=CC(Br)=C(OCC2=CC=CC=C2)C(Br)=C1
Tpsa:
46.53
Logp:
4.8884
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
5
Purity: 95+%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₂F₃N₃
Molecular Weight: 267.25
Synonyms: 3-[4-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILES: C1=C(C=CC(=C1)C(F)(F)F)C2=NNC3=C2CNCC3
Tpsa: 40.71
Logp: 2.7412
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₂F₃N₃
Molecular Weight:
267.25
Synonyms:
3-[4-(trifluoromethyl)phenyl]-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
SMILES:
C1=C(C=CC(=C1)C(F)(F)F)C2=NNC3=C2CNCC3
Tpsa:
40.71
Logp:
2.7412
H Acceptors:
2
H Donors:
2
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: C₁₀H₇F₃N₄O₃
Molecular Weight: 288.18
Synonyms: 3-[4-(Trifluoromethoxy)phenyl]-1,2,4-oxadiazole-5-carbohydrazide
SMILES: O=C(C1=NC(C2=CC=C(OC(F)(F)F)C=C2)=NO1)NN
Tpsa: 103.27
Logp: 1.2387
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇F₃N₄O₃
Molecular Weight:
288.18
Synonyms:
3-[4-(Trifluoromethoxy)phenyl]-1,2,4-oxadiazole-5-carbohydrazide
SMILES:
O=C(C1=NC(C2=CC=C(OC(F)(F)F)C=C2)=NO1)NN
Tpsa:
103.27
Logp:
1.2387
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3