CS-1076999
Benzyl 3-cyano-3-(fluoromethyl)pyrrolidine-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2770500-62-2
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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
C₁₄H₁₅FN₂O₂
Molecular Weight
262.28
Synonyms
None
SMILES
N#CC1(CF)CN(C(=O)OCC=2C=CC=CC2)CC1
Tpsa
53.33
Logp
2.50838
H Acceptors
3
H Donors
0
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: C₁₄H₁₅FN₂O₂
Molecular Weight: 262.28
Synonyms: None
SMILES: N#CC1(CF)CN(C(=O)OCC=2C=CC=CC2)CC1
Tpsa: 53.33
Logp: 2.50838
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₅FN₂O₂
Molecular Weight:
262.28
Synonyms:
None
SMILES:
N#CC1(CF)CN(C(=O)OCC=2C=CC=CC2)CC1
Tpsa:
53.33
Logp:
2.50838
H Acceptors:
3
H Donors:
0
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: C₁₃H₂₁NO₃
Molecular Weight: 239.31
Synonyms: None
SMILES: O=C(OC(C)(C)C)NCC1(C#C)CCOCC1
Tpsa: 47.56
Logp: 1.9411
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:
C₁₃H₂₁NO₃
Molecular Weight:
239.31
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)NCC1(C#C)CCOCC1
Tpsa:
47.56
Logp:
1.9411
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: C₁₅H₂₁NO₃
Molecular Weight: 263.33
Synonyms: None
SMILES: O=C(OCC=1C=CC=CC1)N2CC(O)CC2C(C)C
Tpsa: 49.77
Logp: 2.4144
H Acceptors: 3
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:
C₁₅H₂₁NO₃
Molecular Weight:
263.33
Synonyms:
None
SMILES:
O=C(OCC=1C=CC=CC1)N2CC(O)CC2C(C)C
Tpsa:
49.77
Logp:
2.4144
H Acceptors:
3
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: C₁₆H₂₂N₂O₂S
Molecular Weight: 306.42
Synonyms: None
SMILES: N#CC1=C(SC2=C1C(C)(C)CCC2)NC(=O)OC(C)(C)C
Tpsa: 62.12
Logp: 4.58068
H Acceptors: 4
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:
C₁₆H₂₂N₂O₂S
Molecular Weight:
306.42
Synonyms:
None
SMILES:
N#CC1=C(SC2=C1C(C)(C)CCC2)NC(=O)OC(C)(C)C
Tpsa:
62.12
Logp:
4.58068
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1