CS-1027687
Methyl 4-(pyrrolidine-3-carbonyl)benzoate
Manufacturer: ChemScene
CAS Number: 1780962-47-1
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Purity
95%
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
None
SMILES
O=C(OC)C1=CC=C(C=C1)C(=O)C2CNCC2
Tpsa
55.4
Logp
1.2654
H Acceptors
4
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: 95%
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: None
SMILES: O=C(OC)C1=CC=C(C=C1)C(=O)C2CNCC2
Tpsa: 55.4
Logp: 1.2654
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
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:
None
SMILES:
O=C(OC)C1=CC=C(C=C1)C(=O)C2CNCC2
Tpsa:
55.4
Logp:
1.2654
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₀N₂O₂
Molecular Weight: 214.22
Synonyms: None
SMILES: O=C(O)C=1N=CC(=CN1)C2=CC=C(C=C2)C
Tpsa: 63.08
Logp: 2.15022
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₀N₂O₂
Molecular Weight:
214.22
Synonyms:
None
SMILES:
O=C(O)C=1N=CC(=CN1)C2=CC=C(C=C2)C
Tpsa:
63.08
Logp:
2.15022
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₁₄O₃S
Molecular Weight: 190.26
Synonyms: None
SMILES: O=C(O)C1(CCO)CCSCC1
Tpsa: 57.53
Logp: 0.9668
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₄O₃S
Molecular Weight:
190.26
Synonyms:
None
SMILES:
O=C(O)C1(CCO)CCSCC1
Tpsa:
57.53
Logp:
0.9668
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₁FO₃
Molecular Weight: 210.20
Synonyms: None
SMILES: O=C(O)C(C(=O)C=1C=CC=CC1F)(C)C
Tpsa: 54.37
Logp: 2.1192
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₁FO₃
Molecular Weight:
210.20
Synonyms:
None
SMILES:
O=C(O)C(C(=O)C=1C=CC=CC1F)(C)C
Tpsa:
54.37
Logp:
2.1192
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3