CS-0523730
Methyl 5-chloro-2-(piperazin-1-yl)benzoate
Manufacturer: ChemScene
CAS Number: 849106-87-2
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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
C₁₂H₁₅ClN₂O₂
Molecular Weight
254.71
Synonyms
None
SMILES
O=C(OC)C1=CC(Cl)=CC=C1N2CCNCC2
Tpsa
41.57
Logp
1.5362
H Acceptors
4
H Donors
1
Rotatable Bonds
2
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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
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: C₁₂H₁₅ClN₂O₂
Molecular Weight: 254.71
Synonyms: None
SMILES: O=C(OC)C1=CC(Cl)=CC=C1N2CCNCC2
Tpsa: 41.57
Logp: 1.5362
H Acceptors: 4
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:
C₁₂H₁₅ClN₂O₂
Molecular Weight:
254.71
Synonyms:
None
SMILES:
O=C(OC)C1=CC(Cl)=CC=C1N2CCNCC2
Tpsa:
41.57
Logp:
1.5362
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD18381973
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁NO₂S
Molecular Weight: 173.23
Synonyms: Proline, 5-thioxo-, ethyl ester (9CI)
SMILES: O=C(OCC)[C@H](CC1)NC1=S
Tpsa: 38.33
Logp: 0.6289
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD18381973
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁NO₂S
Molecular Weight:
173.23
Synonyms:
Proline, 5-thioxo-, ethyl ester (9CI)
SMILES:
O=C(OCC)[C@H](CC1)NC1=S
Tpsa:
38.33
Logp:
0.6289
H Acceptors:
3
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: C₉H₁₂N₂O₃
Molecular Weight: 196.20
Synonyms: 3-(3-Amino-4-nitrophenyl)-1-propanol
SMILES: OCCCC1=CC=C([N+]([O-])=O)C(N)=C1
Tpsa: 89.39
Logp: 1.1019
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₂N₂O₃
Molecular Weight:
196.20
Synonyms:
3-(3-Amino-4-nitrophenyl)-1-propanol
SMILES:
OCCCC1=CC=C([N+]([O-])=O)C(N)=C1
Tpsa:
89.39
Logp:
1.1019
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₇NO₈
Molecular Weight: 327.29
Synonyms: Methyl 4,6-O-[(S)-(4-nitrophenyl)methylene]-alpha-D-galactopyranoside
SMILES: O[C@H]([C@H]([C@H]([C@@H](CO1)O2)O[C@H]1C3=CC=C([N+]([O-])=O)C=C3)O)[C@H]2OC
Tpsa: 120.52
Logp: 0.1019
H Acceptors: 8
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:
C₁₄H₁₇NO₈
Molecular Weight:
327.29
Synonyms:
Methyl 4,6-O-[(S)-(4-nitrophenyl)methylene]-alpha-D-galactopyranoside
SMILES:
O[C@H]([C@H]([C@H]([C@@H](CO1)O2)O[C@H]1C3=CC=C([N+]([O-])=O)C=C3)O)[C@H]2OC
Tpsa:
120.52
Logp:
0.1019
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
3