CS-0769580
1-Benzyl-4-(4-Bromophenyl)pyrrolidine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 885959-06-8
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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
C₁₈H₁₈BrNO₂
Molecular Weight
360.25
Synonyms
None
SMILES
OC(C1CN(CC1C2=CC=C(C=C2)Br)CC3=CC=CC=C3)=O
Tpsa
40.54
Logp
3.7493
H Acceptors
2
H Donors
1
Rotatable Bonds
4
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: C₁₈H₁₈BrNO₂
Molecular Weight: 360.25
Synonyms: None
SMILES: OC(C1CN(CC1C2=CC=C(C=C2)Br)CC3=CC=CC=C3)=O
Tpsa: 40.54
Logp: 3.7493
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 4
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₈H₁₈BrNO₂
Molecular Weight:
360.25
Synonyms:
None
SMILES:
OC(C1CN(CC1C2=CC=C(C=C2)Br)CC3=CC=CC=C3)=O
Tpsa:
40.54
Logp:
3.7493
H Acceptors:
2
H Donors:
1
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: C₁₃H₁₆N₂O₅
Molecular Weight: 280.28
Synonyms: None
SMILES: CC(C)(C)OC(=O)NCC(=O)C1=C(C=CC=C1)[N+]([O-])=O
Tpsa: 98.54
Logp: 2.3022
H Acceptors: 5
H Donors: 1
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:
C₁₃H₁₆N₂O₅
Molecular Weight:
280.28
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)NCC(=O)C1=C(C=CC=C1)[N+]([O-])=O
Tpsa:
98.54
Logp:
2.3022
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₁NO₅
Molecular Weight: 249.22
Synonyms: None
SMILES: COC(=O)OC1=CC(=CC2=CC=CN12)C(=O)OC
Tpsa: 66.24
Logp: 1.8711
H Acceptors: 6
H Donors: 0
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:
C₁₂H₁₁NO₅
Molecular Weight:
249.22
Synonyms:
None
SMILES:
COC(=O)OC1=CC(=CC2=CC=CN12)C(=O)OC
Tpsa:
66.24
Logp:
1.8711
H Acceptors:
6
H Donors:
0
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: C₆H₁₃ClN₂
Molecular Weight: 148.63
Synonyms: None
SMILES: Cl.CN1CC2CC1CN2
Tpsa: 15.27
Logp: 0.0841
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₁₃ClN₂
Molecular Weight:
148.63
Synonyms:
None
SMILES:
Cl.CN1CC2CC1CN2
Tpsa:
15.27
Logp:
0.0841
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0