CS-0572337
(3R,4S)-1-(tert-butoxycarbonyl)-4-(3,4-dichlorophenyl)pyrrolidine-3-carboxylic acid
Manufacturer: ChemScene
CAS Number: 1160260-94-5
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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
C₁₆H₁₉Cl₂NO₄
Molecular Weight
360.23
Synonyms
Boc-(+/-)-trans-4-(3,4-dichloro-phenyl)-pyrrolidine-3-carboxylic acid
SMILES
CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)C(=O)O)C2=CC(=C(C=C2)Cl)Cl
Tpsa
66.84
Logp
4.0285
H Acceptors
3
H Donors
1
Rotatable Bonds
2
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1160260-94-5 | 1,3-Pyrrolidinedicarboxylic acid, 4-(3,4-dichlorophenyl)-, 1-(1,1-dimethylethyl) ester, (3R,4S)-rel- | A2B Chem | -- |
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: C₁₆H₁₉Cl₂NO₄
Molecular Weight: 360.23
Synonyms: Boc-(+/-)-trans-4-(3,4-dichloro-phenyl)-pyrrolidine-3-carboxylic acid
SMILES: CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)C(=O)O)C2=CC(=C(C=C2)Cl)Cl
Tpsa: 66.84
Logp: 4.0285
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:
C₁₆H₁₉Cl₂NO₄
Molecular Weight:
360.23
Synonyms:
Boc-(+/-)-trans-4-(3,4-dichloro-phenyl)-pyrrolidine-3-carboxylic acid
SMILES:
CC(C)(C)OC(=O)N1C[C@@H]([C@H](C1)C(=O)O)C2=CC(=C(C=C2)Cl)Cl
Tpsa:
66.84
Logp:
4.0285
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: C₁₈H₂₅NO₅
Molecular Weight: 335.39
Synonyms: 1,3-Pyrrolidinedicarboxylic acid, 4-[3-(methoxymethyl)phenyl]-, 1-(1,1-dimethylethyl) ester, (3R,4S)-rel-
SMILES: CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)O)C2=CC=CC(=C2)COC
Tpsa: 76.07
Logp: 2.8681
H Acceptors: 4
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:
C₁₈H₂₅NO₅
Molecular Weight:
335.39
Synonyms:
1,3-Pyrrolidinedicarboxylic acid, 4-[3-(methoxymethyl)phenyl]-, 1-(1,1-dimethylethyl) ester, (3R,4S)-rel-
SMILES:
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)O)C2=CC=CC(=C2)COC
Tpsa:
76.07
Logp:
2.8681
H Acceptors:
4
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: C₁₅H₂₃NO₃
Molecular Weight: 265.35
Synonyms: Carbamic acid, N-[(1S)-1-(hydroxymethyl)-3-phenylpropyl]-, 1,1-dimethylethyl ester
SMILES: CC(C)(C)OC(=O)N[C@@H](CCC1=CC=CC=C1)CO
Tpsa: 58.56
Logp: 2.5048
H Acceptors: 3
H Donors: 2
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:
C₁₅H₂₃NO₃
Molecular Weight:
265.35
Synonyms:
Carbamic acid, N-[(1S)-1-(hydroxymethyl)-3-phenylpropyl]-, 1,1-dimethylethyl ester
SMILES:
CC(C)(C)OC(=O)N[C@@H](CCC1=CC=CC=C1)CO
Tpsa:
58.56
Logp:
2.5048
H Acceptors:
3
H Donors:
2
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: C₁₅H₂₃NO₃
Molecular Weight: 265.35
Synonyms: Boc-(R)-2-amino-4-phenylbutan-1-ol
SMILES: CC(C)(C)OC(=O)N[C@H](CCC1=CC=CC=C1)CO
Tpsa: 58.56
Logp: 2.5048
H Acceptors: 3
H Donors: 2
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:
C₁₅H₂₃NO₃
Molecular Weight:
265.35
Synonyms:
Boc-(R)-2-amino-4-phenylbutan-1-ol
SMILES:
CC(C)(C)OC(=O)N[C@H](CCC1=CC=CC=C1)CO
Tpsa:
58.56
Logp:
2.5048
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
5