CS-0569061
Methyl (E)-3-(3-(tert-butoxy)-3-oxoprop-1-en-1-yl)benzoate
Manufacturer: ChemScene
CAS Number: 279240-83-4
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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
C₁₅H₁₈O₄
Molecular Weight
262.30
Synonyms
None
SMILES
O=C(OC)C1=CC=CC(/C=C/C(OC(C)(C)C)=O)=C1
Tpsa
52.6
Logp
2.8281
H Acceptors
4
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: C₁₅H₁₈O₄
Molecular Weight: 262.30
Synonyms: None
SMILES: O=C(OC)C1=CC=CC(/C=C/C(OC(C)(C)C)=O)=C1
Tpsa: 52.6
Logp: 2.8281
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:
C₁₅H₁₈O₄
Molecular Weight:
262.30
Synonyms:
None
SMILES:
O=C(OC)C1=CC=CC(/C=C/C(OC(C)(C)C)=O)=C1
Tpsa:
52.6
Logp:
2.8281
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: C₁₆H₁₆BrNO
Molecular Weight: 318.21
Synonyms: None
SMILES: BrC1=CC=C2CN(CC3=CC=CC=C3)CCOC2=C1
Tpsa: 12.47
Logp: 3.8437
H Acceptors: 2
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:
C₁₆H₁₆BrNO
Molecular Weight:
318.21
Synonyms:
None
SMILES:
BrC1=CC=C2CN(CC3=CC=CC=C3)CCOC2=C1
Tpsa:
12.47
Logp:
3.8437
H Acceptors:
2
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: C₈H₁₁N₃OS
Molecular Weight: 197.26
Synonyms: None
SMILES: O=C(N1CCNCC1)C2=NC=CS2
Tpsa: 45.23
Logp: 0.1885
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:
C₈H₁₁N₃OS
Molecular Weight:
197.26
Synonyms:
None
SMILES:
O=C(N1CCNCC1)C2=NC=CS2
Tpsa:
45.23
Logp:
0.1885
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: C₈H₁₄ClN
Molecular Weight: 159.66
Synonyms: rac-(3aR,7aS)-2,3,3a,4,7,7a-hexahydro-1H-isoindole hydrochloride, cis
SMILES: C1C=CC[C@@H]2[C@H]1CNC2.Cl
Tpsa: 12.03
Logp: 1.5938
H Acceptors: 1
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:
C₈H₁₄ClN
Molecular Weight:
159.66
Synonyms:
rac-(3aR,7aS)-2,3,3a,4,7,7a-hexahydro-1H-isoindole hydrochloride, cis
SMILES:
C1C=CC[C@@H]2[C@H]1CNC2.Cl
Tpsa:
12.03
Logp:
1.5938
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0