CS-0375096
3-(Bicyclo[4.2.0]octa-1,3,5-trien-3-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 2271393-80-5
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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
C₁₁H₁₂O₂
Molecular Weight
176.21
Synonyms
Bicyclo[4.2.0]octa-1,3,5-triene-3-propanoic acid
SMILES
O=C(O)CCC1=CC=C2CCC2=C1
Tpsa
37.3
Logp
1.8024
H Acceptors
1
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: C₁₁H₁₂O₂
Molecular Weight: 176.21
Synonyms: Bicyclo[4.2.0]octa-1,3,5-triene-3-propanoic acid
SMILES: O=C(O)CCC1=CC=C2CCC2=C1
Tpsa: 37.3
Logp: 1.8024
H Acceptors: 1
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:
C₁₁H₁₂O₂
Molecular Weight:
176.21
Synonyms:
Bicyclo[4.2.0]octa-1,3,5-triene-3-propanoic acid
SMILES:
O=C(O)CCC1=CC=C2CCC2=C1
Tpsa:
37.3
Logp:
1.8024
H Acceptors:
1
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: C₁₂H₉BrN₂O₂
Molecular Weight: 293.12
Synonyms: None
SMILES: N#CC1=CN=C(Br)C2=C1C=C(OC)C(OC)=C2
Tpsa: 55.14
Logp: 2.88618
H Acceptors: 4
H Donors: 0
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:
C₁₂H₉BrN₂O₂
Molecular Weight:
293.12
Synonyms:
None
SMILES:
N#CC1=CN=C(Br)C2=C1C=C(OC)C(OC)=C2
Tpsa:
55.14
Logp:
2.88618
H Acceptors:
4
H Donors:
0
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: C₁₄H₁₉ClN₂O₂
Molecular Weight: 282.77
Synonyms: 1,6-Naphthyridine-6(5H)-carboxylic acid, 2-chloro-7,8-dihydro-8-methyl-, 1,1-dimethylethyl ester
SMILES: O=C(N1CC2=C(N=C(Cl)C=C2)C(C)C1)OC(C)(C)C
Tpsa: 42.43
Logp: 3.5892
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₉ClN₂O₂
Molecular Weight:
282.77
Synonyms:
1,6-Naphthyridine-6(5H)-carboxylic acid, 2-chloro-7,8-dihydro-8-methyl-, 1,1-dimethylethyl ester
SMILES:
O=C(N1CC2=C(N=C(Cl)C=C2)C(C)C1)OC(C)(C)C
Tpsa:
42.43
Logp:
3.5892
H Acceptors:
3
H Donors:
0
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: C₁₂H₂₀N₂O₃
Molecular Weight: 240.30
Synonyms: 3,8-Diazabicyclo[3.2.1]octane-8-carboxylic acid, 1-formyl-, 1,1-dimethylethyl ester
SMILES: O=C(N1C2(C=O)CNCC1CC2)OC(C)(C)C
Tpsa: 58.64
Logp: 0.9268
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:
C₁₂H₂₀N₂O₃
Molecular Weight:
240.30
Synonyms:
3,8-Diazabicyclo[3.2.1]octane-8-carboxylic acid, 1-formyl-, 1,1-dimethylethyl ester
SMILES:
O=C(N1C2(C=O)CNCC1CC2)OC(C)(C)C
Tpsa:
58.64
Logp:
0.9268
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1