CS-0587495
4-((4-Oxopiperidin-1-yl)methyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 938118-92-4
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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
C₁₃H₁₅NO₃
Molecular Weight
233.26
Synonyms
4-[(4-Oxo-1-piperidinyl)methyl]benzoic acid
SMILES
C1CN(CCC1=O)CC2=CC=C(C=C2)C(=O)O
Tpsa
57.61
Logp
1.5497
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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: C₁₃H₁₅NO₃
Molecular Weight: 233.26
Synonyms: 4-[(4-Oxo-1-piperidinyl)methyl]benzoic acid
SMILES: C1CN(CCC1=O)CC2=CC=C(C=C2)C(=O)O
Tpsa: 57.61
Logp: 1.5497
H Acceptors: 3
H Donors: 1
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:
C₁₃H₁₅NO₃
Molecular Weight:
233.26
Synonyms:
4-[(4-Oxo-1-piperidinyl)methyl]benzoic acid
SMILES:
C1CN(CCC1=O)CC2=CC=C(C=C2)C(=O)O
Tpsa:
57.61
Logp:
1.5497
H Acceptors:
3
H Donors:
1
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: C₁₁H₁₇NO₂
Molecular Weight: 195.26
Synonyms: None
SMILES: CCCOCCOC1=CC=CC=C1N
Tpsa: 44.48
Logp: 2.0742
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₇NO₂
Molecular Weight:
195.26
Synonyms:
None
SMILES:
CCCOCCOC1=CC=CC=C1N
Tpsa:
44.48
Logp:
2.0742
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: MFCD18064651
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₃NO₂S
Molecular Weight: 199.27
Synonyms: 5-tert-butyl-4-methyl-1,3-thiazole-2-carboxylate
SMILES: O=C(C1=NC(C)=C(C(C)(C)C)S1)O
Tpsa: 53.02
Logp: -1.88348
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD18064651
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₃NO₂S
Molecular Weight:
199.27
Synonyms:
5-tert-butyl-4-methyl-1,3-thiazole-2-carboxylate
SMILES:
O=C(C1=NC(C)=C(C(C)(C)C)S1)O
Tpsa:
53.02
Logp:
-1.88348
H Acceptors:
4
H Donors:
0
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: C₁₁H₁₃N₃O₄
Molecular Weight: 251.24
Synonyms: 1-(5-NITROPYRIDIN-2-YL)-3-PIPERIDINECARBOXYLIC ACID
SMILES: O=C(C1CN(C2=NC=C([N+]([O-])=O)C=C2)CCC1)O
Tpsa: 96.57
Logp: 1.2908
H Acceptors: 5
H Donors: 1
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:
C₁₁H₁₃N₃O₄
Molecular Weight:
251.24
Synonyms:
1-(5-NITROPYRIDIN-2-YL)-3-PIPERIDINECARBOXYLIC ACID
SMILES:
O=C(C1CN(C2=NC=C([N+]([O-])=O)C=C2)CCC1)O
Tpsa:
96.57
Logp:
1.2908
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
3