CS-0782899
rel-(3R,4S)-4-(4-Chloro-3-fluorophenyl)-1-(phenylmethyl)-3-pyrrolidinamine
Manufacturer: ChemScene
CAS Number: 1221174-06-6
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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
C₁₇H₁₈ClFN₂
Molecular Weight
304.79
Synonyms
None
SMILES
N[C@@H]1[C@@H](C2=CC(F)=C(C=C2)Cl)CN(C1)CC3=CC=CC=C3
Tpsa
29.26
Logp
3.4058
H Acceptors
2
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: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₈ClFN₂
Molecular Weight: 304.79
Synonyms: None
SMILES: N[C@@H]1[C@@H](C2=CC(F)=C(C=C2)Cl)CN(C1)CC3=CC=CC=C3
Tpsa: 29.26
Logp: 3.4058
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:
C₁₇H₁₈ClFN₂
Molecular Weight:
304.79
Synonyms:
None
SMILES:
N[C@@H]1[C@@H](C2=CC(F)=C(C=C2)Cl)CN(C1)CC3=CC=CC=C3
Tpsa:
29.26
Logp:
3.4058
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: C₂₂H₂₆F₂N₂O₂
Molecular Weight: 388.45
Synonyms: None
SMILES: CC(C)(C)OC(N[C@@H]1[C@@H](C2=C(C=C(C=C2)F)F)CN(C1)CC3=CC=CC=C3)=O
Tpsa: 41.57
Logp: 4.4575
H Acceptors: 3
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:
C₂₂H₂₆F₂N₂O₂
Molecular Weight:
388.45
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@@H]1[C@@H](C2=C(C=C(C=C2)F)F)CN(C1)CC3=CC=CC=C3)=O
Tpsa:
41.57
Logp:
4.4575
H Acceptors:
3
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: C₁₇H₁₇FN₂O₂
Molecular Weight: 300.33
Synonyms: None
SMILES: FC1=CC=CC([C@@H](CN(C2)CC3=CC=CC=C3)[C@H]2[N+]([O-])=O)=C1
Tpsa: 46.38
Logp: 3.0704
H Acceptors: 3
H Donors: 0
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:
C₁₇H₁₇FN₂O₂
Molecular Weight:
300.33
Synonyms:
None
SMILES:
FC1=CC=CC([C@@H](CN(C2)CC3=CC=CC=C3)[C@H]2[N+]([O-])=O)=C1
Tpsa:
46.38
Logp:
3.0704
H Acceptors:
3
H Donors:
0
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: C₁₆H₂₃FN₂O₂
Molecular Weight: 294.36
Synonyms: None
SMILES: N[C@@H]1[C@@H](C2=CC(C)=C(C=C2)F)CN(C1)C(OC(C)(C)C)=O
Tpsa: 55.56
Logp: 2.79572
H Acceptors: 3
H Donors: 1
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:
C₁₆H₂₃FN₂O₂
Molecular Weight:
294.36
Synonyms:
None
SMILES:
N[C@@H]1[C@@H](C2=CC(C)=C(C=C2)F)CN(C1)C(OC(C)(C)C)=O
Tpsa:
55.56
Logp:
2.79572
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1