CS-0254223
Benzyl (4-(difluoromethyl)bicyclo[2.2.2]octan-1-yl)carbamate
Manufacturer: ChemScene
CAS Number: 1252672-41-5
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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
C₁₇H₂₁F₂NO₂
Molecular Weight
309.35
Synonyms
Carbamic acid, N-[4-(difluoromethyl)bicyclo[2.2.2]oct-1-yl]-, phenylmethyl ester
SMILES
O=C(OCC1=CC=CC=C1)NC2(CC3)CCC3(C(F)F)CC2
Tpsa
38.33
Logp
4.2709
H Acceptors
2
H Donors
1
Rotatable Bonds
4
Related Products
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: C₁₇H₂₁F₂NO₂
Molecular Weight: 309.35
Synonyms: Carbamic acid, N-[4-(difluoromethyl)bicyclo[2.2.2]oct-1-yl]-, phenylmethyl ester
SMILES: O=C(OCC1=CC=CC=C1)NC2(CC3)CCC3(C(F)F)CC2
Tpsa: 38.33
Logp: 4.2709
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:
C₁₇H₂₁F₂NO₂
Molecular Weight:
309.35
Synonyms:
Carbamic acid, N-[4-(difluoromethyl)bicyclo[2.2.2]oct-1-yl]-, phenylmethyl ester
SMILES:
O=C(OCC1=CC=CC=C1)NC2(CC3)CCC3(C(F)F)CC2
Tpsa:
38.33
Logp:
4.2709
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₄O₃
Molecular Weight: 100.07
Synonyms: Hydroxybutynoicacid
SMILES: C#CC(O)C(O)=O
Tpsa: 57.53
Logp: -0.9349
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₄O₃
Molecular Weight:
100.07
Synonyms:
Hydroxybutynoicacid
SMILES:
C#CC(O)C(O)=O
Tpsa:
57.53
Logp:
-0.9349
H Acceptors:
2
H Donors:
2
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: C₁₁H₂₁NO₄S
Molecular Weight: 263.35
Synonyms: None
SMILES: O=C(N1CC(CS(=O)(CC)=O)C1)OC(C)(C)C
Tpsa: 63.68
Logp: 1.288
H Acceptors: 4
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:
C₁₁H₂₁NO₄S
Molecular Weight:
263.35
Synonyms:
None
SMILES:
O=C(N1CC(CS(=O)(CC)=O)C1)OC(C)(C)C
Tpsa:
63.68
Logp:
1.288
H Acceptors:
4
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: C₁₁H₂₀FNO₃
Molecular Weight: 233.28
Synonyms: 1-Piperidinecarboxylic acid, 3-fluoro-4-hydroxy-3-methyl-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC(C)(F)C(O)CC1)OC(C)(C)C
Tpsa: 49.77
Logp: 1.7163
H Acceptors: 3
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:
C₁₁H₂₀FNO₃
Molecular Weight:
233.28
Synonyms:
1-Piperidinecarboxylic acid, 3-fluoro-4-hydroxy-3-methyl-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC(C)(F)C(O)CC1)OC(C)(C)C
Tpsa:
49.77
Logp:
1.7163
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
0