CS-0291543
1-(3,4-Difluorobenzyl)pyrrolidine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1828197-59-6
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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
C₁₂H₁₃F₂NO₂
Molecular Weight
241.23
Synonyms
None
SMILES
O=C(C1CN(CC2=CC=C(F)C(F)=C2)CC1)O
Tpsa
40.54
Logp
1.8713
H Acceptors
2
H Donors
1
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: C₁₂H₁₃F₂NO₂
Molecular Weight: 241.23
Synonyms: None
SMILES: O=C(C1CN(CC2=CC=C(F)C(F)=C2)CC1)O
Tpsa: 40.54
Logp: 1.8713
H Acceptors: 2
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:
C₁₂H₁₃F₂NO₂
Molecular Weight:
241.23
Synonyms:
None
SMILES:
O=C(C1CN(CC2=CC=C(F)C(F)=C2)CC1)O
Tpsa:
40.54
Logp:
1.8713
H Acceptors:
2
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: C₁₂H₂₂N₂O₃
Molecular Weight: 242.31
Synonyms: 3-Piperidinecarboxylic acid, 1-[3-(methylamino)-3-oxopropyl]-, ethyl ester
SMILES: O=C(C1CN(CCC(NC)=O)CCC1)OCC
Tpsa: 58.64
Logp: 0.3976
H Acceptors: 4
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:
C₁₂H₂₂N₂O₃
Molecular Weight:
242.31
Synonyms:
3-Piperidinecarboxylic acid, 1-[3-(methylamino)-3-oxopropyl]-, ethyl ester
SMILES:
O=C(C1CN(CCC(NC)=O)CCC1)OCC
Tpsa:
58.64
Logp:
0.3976
H Acceptors:
4
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: C₆H₁₁NO₄S
Molecular Weight: 193.22
Synonyms: 1-methanesulfonylpyrrolidine-3-carboxylic acid
SMILES: O=C(C1CN(S(=O)(C)=O)CC1)O
Tpsa: 74.68
Logp: -0.6475
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:
C₆H₁₁NO₄S
Molecular Weight:
193.22
Synonyms:
1-methanesulfonylpyrrolidine-3-carboxylic acid
SMILES:
O=C(C1CN(S(=O)(C)=O)CC1)O
Tpsa:
74.68
Logp:
-0.6475
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: C₉H₁₀BrNO₄S₂
Molecular Weight: 340.21
Synonyms: None
SMILES: O=C(C1CN(S(=O)(C2=C(Br)C=CS2)=O)CC1)O
Tpsa: 74.68
Logp: 1.6058
H Acceptors: 4
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:
C₉H₁₀BrNO₄S₂
Molecular Weight:
340.21
Synonyms:
None
SMILES:
O=C(C1CN(S(=O)(C2=C(Br)C=CS2)=O)CC1)O
Tpsa:
74.68
Logp:
1.6058
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3