CS-0470381
Methyl 5-(3-(tert-butoxy)-3-oxopropyl)-1H-pyrrole-2-carboxylate
Manufacturer: ChemScene
CAS Number: 1041430-17-4
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Purity
98%
MDL No
MFCD26386082
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₉NO₄
Molecular Weight
253.29
Synonyms
1H-Pyrrole-2-propanoic acid, 5-(methoxycarbonyl)-, 1,1-dimethylethyl ester
SMILES
COC(=O)C1=CC=C(CCC(=O)OC(C)(C)C)N1
Tpsa
68.39
Logp
2.0756
H Acceptors
4
H Donors
1
Rotatable Bonds
4
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1041430-17-4 | Methyl 5-(3-(tert-butoxy)-3-oxopropyl)-1H-pyrrole-2-carboxylate | A2B Chem | -- |
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: MFCD26386082
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₉NO₄
Molecular Weight: 253.29
Synonyms: 1H-Pyrrole-2-propanoic acid, 5-(methoxycarbonyl)-, 1,1-dimethylethyl ester
SMILES: COC(=O)C1=CC=C(CCC(=O)OC(C)(C)C)N1
Tpsa: 68.39
Logp: 2.0756
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
MFCD26386082
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₉NO₄
Molecular Weight:
253.29
Synonyms:
1H-Pyrrole-2-propanoic acid, 5-(methoxycarbonyl)-, 1,1-dimethylethyl ester
SMILES:
COC(=O)C1=CC=C(CCC(=O)OC(C)(C)C)N1
Tpsa:
68.39
Logp:
2.0756
H Acceptors:
4
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: C₁₃H₁₇NO₄
Molecular Weight: 251.28
Synonyms: (E)-methyl 5-(3-(tert-butoxy)-3-oxoprop-1-en-1-yl)-1H-pyrrole-2-carboxylate
SMILES: COC(=O)C1=CC=C(N1)\C=C\C(=O)OC(C)(C)C
Tpsa: 68.39
Logp: 2.1562
H Acceptors: 4
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:
C₁₃H₁₇NO₄
Molecular Weight:
251.28
Synonyms:
(E)-methyl 5-(3-(tert-butoxy)-3-oxoprop-1-en-1-yl)-1H-pyrrole-2-carboxylate
SMILES:
COC(=O)C1=CC=C(N1)\C=C\C(=O)OC(C)(C)C
Tpsa:
68.39
Logp:
2.1562
H Acceptors:
4
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: C₆H₁₃BO₂
Molecular Weight: 127.98
Synonyms: [(1Z)-3,3-Dimethylbut-1-en-1-yl]boronic acid
SMILES: CC(C)(C)\C=C/B(O)O
Tpsa: 40.46
Logp: 0.6007
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:
C₆H₁₃BO₂
Molecular Weight:
127.98
Synonyms:
[(1Z)-3,3-Dimethylbut-1-en-1-yl]boronic acid
SMILES:
CC(C)(C)\C=C/B(O)O
Tpsa:
40.46
Logp:
0.6007
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: C₁₉H₂₇NO₅
Molecular Weight: 349.42
Synonyms: L-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-, 2-propen-1-yl ester
SMILES: C[C@@H](OCC1=CC=CC=C1)[C@H](NC(=O)OC(C)(C)C)C(=O)OCC=C
Tpsa: 73.86
Logp: 3.2142
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₇NO₅
Molecular Weight:
349.42
Synonyms:
L-Threonine, N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-, 2-propen-1-yl ester
SMILES:
C[C@@H](OCC1=CC=CC=C1)[C@H](NC(=O)OC(C)(C)C)C(=O)OCC=C
Tpsa:
73.86
Logp:
3.2142
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
8