CS-0349595
4-(4-Chloro-1h-pyrrole-2-carbonyl)piperazin-2-one
Manufacturer: ChemScene
CAS Number: 1247610-27-0
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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
C₉H₁₀ClN₃O₂
Molecular Weight
227.65
Synonyms
None
SMILES
O=C1NCCN(C(C2=CC(Cl)=CN2)=O)C1
Tpsa
65.2
Logp
0.2401
H Acceptors
2
H Donors
2
Rotatable Bonds
1
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₉H₁₀ClN₃O₂
Molecular Weight: 227.65
Synonyms: None
SMILES: O=C1NCCN(C(C2=CC(Cl)=CN2)=O)C1
Tpsa: 65.2
Logp: 0.2401
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:
C₉H₁₀ClN₃O₂
Molecular Weight:
227.65
Synonyms:
None
SMILES:
O=C1NCCN(C(C2=CC(Cl)=CN2)=O)C1
Tpsa:
65.2
Logp:
0.2401
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: C₁₁H₁₀BrFN₂O₂
Molecular Weight: 301.11
Synonyms: None
SMILES: O=C1NCCN(C(C2=CC(F)=CC(Br)=C2)=O)C1
Tpsa: 49.41
Logp: 1.1602
H Acceptors: 2
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:
C₁₁H₁₀BrFN₂O₂
Molecular Weight:
301.11
Synonyms:
None
SMILES:
O=C1NCCN(C(C2=CC(F)=CC(Br)=C2)=O)C1
Tpsa:
49.41
Logp:
1.1602
H Acceptors:
2
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: C₉H₉N₃O₄S
Molecular Weight: 255.25
Synonyms: None
SMILES: O=C1NCCN(C(C2=CC=C([N+]([O-])=O)S2)=O)C1
Tpsa: 92.55
Logp: 0.2283
H Acceptors: 5
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:
C₉H₉N₃O₄S
Molecular Weight:
255.25
Synonyms:
None
SMILES:
O=C1NCCN(C(C2=CC=C([N+]([O-])=O)S2)=O)C1
Tpsa:
92.55
Logp:
0.2283
H Acceptors:
5
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: C₉H₉ClN₂O₃
Molecular Weight: 228.63
Synonyms: None
SMILES: O=C1NCCN(C(C2=CC=C(Cl)O2)=O)C1
Tpsa: 62.55
Logp: 0.505
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:
C₉H₉ClN₂O₃
Molecular Weight:
228.63
Synonyms:
None
SMILES:
O=C1NCCN(C(C2=CC=C(Cl)O2)=O)C1
Tpsa:
62.55
Logp:
0.505
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1