CS-0310814
Benzyl 3-hydroxybicyclo[1.1.1]pentane-1-carboxylate
Manufacturer: ChemScene
CAS Number: 2655547-51-4
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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
C₁₃H₁₄O₃
Molecular Weight
218.25
Synonyms
3-Hydroxy-bicyclo[1.1.1]pentane-1-carboxylic acid benzyl ester
SMILES
O=C(C1(C2)CC2(O)C1)OCC3=CC=CC=C3
Tpsa
46.53
Logp
1.6448
H Acceptors
3
H Donors
1
Rotatable Bonds
3
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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: C₁₃H₁₄O₃
Molecular Weight: 218.25
Synonyms: 3-Hydroxy-bicyclo[1.1.1]pentane-1-carboxylic acid benzyl ester
SMILES: O=C(C1(C2)CC2(O)C1)OCC3=CC=CC=C3
Tpsa: 46.53
Logp: 1.6448
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:
C₁₃H₁₄O₃
Molecular Weight:
218.25
Synonyms:
3-Hydroxy-bicyclo[1.1.1]pentane-1-carboxylic acid benzyl ester
SMILES:
O=C(C1(C2)CC2(O)C1)OCC3=CC=CC=C3
Tpsa:
46.53
Logp:
1.6448
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: C₁₉H₂₅BO₄
Molecular Weight: 328.21
Synonyms: None
SMILES: O=C(C1(C2)CC2(B3OC(C)(C)C(C)(C)O3)C1)OCC4=CC=CC=C4
Tpsa: 44.76
Logp: 3.7463
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:
C₁₉H₂₅BO₄
Molecular Weight:
328.21
Synonyms:
None
SMILES:
O=C(C1(C2)CC2(B3OC(C)(C)C(C)(C)O3)C1)OCC4=CC=CC=C4
Tpsa:
44.76
Logp:
3.7463
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: C₁₄H₁₄O₄
Molecular Weight: 246.26
Synonyms: Bicyclo[1.1.1]pentane-1,3-dicarboxylic acid, 1-(phenylmethyl) ester
SMILES: O=C(C1(C2)CC2(C(O)=O)C1)OCC3=CC=CC=C3
Tpsa: 63.6
Logp: 1.9847
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:
C₁₄H₁₄O₄
Molecular Weight:
246.26
Synonyms:
Bicyclo[1.1.1]pentane-1,3-dicarboxylic acid, 1-(phenylmethyl) ester
SMILES:
O=C(C1(C2)CC2(C(O)=O)C1)OCC3=CC=CC=C3
Tpsa:
63.6
Logp:
1.9847
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
4
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₉BF₃KO₂
Molecular Weight: 232.05
Synonyms: Potassium; trifluoro-(3-methoxycarbonyl-1-bicyclo[1.1.1]pentanyl)boranuide
SMILES: O=C(C12C[C-](C2)([B+3]([F-])([F-])[F-])C1)OC.[K+]
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉BF₃KO₂
Molecular Weight:
232.05
Synonyms:
Potassium; trifluoro-(3-methoxycarbonyl-1-bicyclo[1.1.1]pentanyl)boranuide
SMILES:
O=C(C12C[C-](C2)([B+3]([F-])([F-])[F-])C1)OC.[K+]
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A