CS-0586883
4-(4-(Hydroxymethyl)piperidin-1-yl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1022929-24-3
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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
C₁₃H₁₇NO₃
Molecular Weight
235.28
Synonyms
4-(4-(hydroxymethyl)piperidin-1-yl)benzoicacid
SMILES
O=C(O)C1=CC=C(N2CCC(CO)CC2)C=C1
Tpsa
60.77
Logp
1.5935
H Acceptors
3
H Donors
2
Rotatable Bonds
3
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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: C₁₃H₁₇NO₃
Molecular Weight: 235.28
Synonyms: 4-(4-(hydroxymethyl)piperidin-1-yl)benzoicacid
SMILES: O=C(O)C1=CC=C(N2CCC(CO)CC2)C=C1
Tpsa: 60.77
Logp: 1.5935
H Acceptors: 3
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:
C₁₃H₁₇NO₃
Molecular Weight:
235.28
Synonyms:
4-(4-(hydroxymethyl)piperidin-1-yl)benzoicacid
SMILES:
O=C(O)C1=CC=C(N2CCC(CO)CC2)C=C1
Tpsa:
60.77
Logp:
1.5935
H Acceptors:
3
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: C₁₂H₁₀F₃NO₃
Molecular Weight: 273.21
Synonyms: None
SMILES: C1C(C1C(=O)O)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Tpsa: 66.4
Logp: 2.3646
H Acceptors: 2
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:
C₁₂H₁₀F₃NO₃
Molecular Weight:
273.21
Synonyms:
None
SMILES:
C1C(C1C(=O)O)C(=O)NC2=CC=C(C=C2)C(F)(F)F
Tpsa:
66.4
Logp:
2.3646
H Acceptors:
2
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: C₁₄H₁₅N₅O
Molecular Weight: 269.30
Synonyms: None
SMILES: C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=CC=N3
Tpsa: 62.22
Logp: 0.834
H Acceptors: 5
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:
C₁₄H₁₅N₅O
Molecular Weight:
269.30
Synonyms:
None
SMILES:
C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC=CC=N3
Tpsa:
62.22
Logp:
0.834
H Acceptors:
5
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: C₇H₆BrIN₂O
Molecular Weight: 340.94
Synonyms: None
SMILES: C1=CC(=C(C=C1I)C(=O)NN)Br
Tpsa: 55.12
Logp: 1.6572
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:
C₇H₆BrIN₂O
Molecular Weight:
340.94
Synonyms:
None
SMILES:
C1=CC(=C(C=C1I)C(=O)NN)Br
Tpsa:
55.12
Logp:
1.6572
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
1