CS-0617140
tert-Butyl 2-(3-(2-cyanoacetyl)cyclopentyl)acetate
Manufacturer: ChemScene
CAS Number: 2821784-62-5
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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
C₁₄H₂₁NO₃
Molecular Weight
251.32
Synonyms
None
SMILES
O=C(OC(C)(C)C)CC1CC(C(CC#N)=O)CC1
Tpsa
67.16
Logp
2.61728
H Acceptors
4
H Donors
0
Rotatable Bonds
4
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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: C₁₄H₂₁NO₃
Molecular Weight: 251.32
Synonyms: None
SMILES: O=C(OC(C)(C)C)CC1CC(C(CC#N)=O)CC1
Tpsa: 67.16
Logp: 2.61728
H Acceptors: 4
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:
C₁₄H₂₁NO₃
Molecular Weight:
251.32
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)CC1CC(C(CC#N)=O)CC1
Tpsa:
67.16
Logp:
2.61728
H Acceptors:
4
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: C₁₀H₁₁F₃O₅S
Molecular Weight: 300.25
Synonyms: None
SMILES: O=C([C@H]1[C@]2([H])CC(OS(=O)(C(F)(F)F)=O)=C[C@]12[H])OCC
Tpsa: 69.67
Logp: 1.5655
H Acceptors: 5
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:
C₁₀H₁₁F₃O₅S
Molecular Weight:
300.25
Synonyms:
None
SMILES:
O=C([C@H]1[C@]2([H])CC(OS(=O)(C(F)(F)F)=O)=C[C@]12[H])OCC
Tpsa:
69.67
Logp:
1.5655
H Acceptors:
5
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: C₆H₆ClF₂NO
Molecular Weight: 181.57
Synonyms: None
SMILES: OC1=CC=CN=C1C(F)F.Cl
Tpsa: 33.12
Logp: 2.1466
H Acceptors: 2
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:
C₆H₆ClF₂NO
Molecular Weight:
181.57
Synonyms:
None
SMILES:
OC1=CC=CN=C1C(F)F.Cl
Tpsa:
33.12
Logp:
2.1466
H Acceptors:
2
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: C₅H₄N₄S
Molecular Weight: 152.18
Synonyms: None
SMILES: NC1=C(SC=N2)C2=NC=N1
Tpsa: 64.69
Logp: 0.6685
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₄N₄S
Molecular Weight:
152.18
Synonyms:
None
SMILES:
NC1=C(SC=N2)C2=NC=N1
Tpsa:
64.69
Logp:
0.6685
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
0