CS-0770086
1-Acetyl-2-Ethoxycarbonylmethyl-1H-pyrrole-3-carboxylic acid ethyl ester
Manufacturer: ChemScene
CAS Number: 942205-97-2
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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
C₁₃H₁₇NO₅
Molecular Weight
267.28
Synonyms
None
SMILES
CCOC(=O)CC1=C(C=CN1C(C)=O)C(=O)OCC
Tpsa
74.6
Logp
1.4305
H Acceptors
6
H Donors
0
Rotatable Bonds
5
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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: C₁₃H₁₇NO₅
Molecular Weight: 267.28
Synonyms: None
SMILES: CCOC(=O)CC1=C(C=CN1C(C)=O)C(=O)OCC
Tpsa: 74.6
Logp: 1.4305
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₇NO₅
Molecular Weight:
267.28
Synonyms:
None
SMILES:
CCOC(=O)CC1=C(C=CN1C(C)=O)C(=O)OCC
Tpsa:
74.6
Logp:
1.4305
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉NO₂
Molecular Weight: 151.16
Synonyms: None
SMILES: COC(=O)C1=CN(C=C)C=C1
Tpsa: 31.23
Logp: 1.3752
H Acceptors: 3
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:
C₈H₉NO₂
Molecular Weight:
151.16
Synonyms:
None
SMILES:
COC(=O)C1=CN(C=C)C=C1
Tpsa:
31.23
Logp:
1.3752
H Acceptors:
3
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: C₈H₁₀ClNO₂
Molecular Weight: 187.62
Synonyms: None
SMILES: COC(=O)C1=CN(CCCl)C=C1
Tpsa: 31.23
Logp: 1.5135
H Acceptors: 3
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:
C₈H₁₀ClNO₂
Molecular Weight:
187.62
Synonyms:
None
SMILES:
COC(=O)C1=CN(CCCl)C=C1
Tpsa:
31.23
Logp:
1.5135
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₀ClIO
Molecular Weight: 344.58
Synonyms: None
SMILES: ClC1=CC(I)=CC=C1OCC1=CC=CC=C1
Tpsa: 9.23
Logp: 4.5236
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀ClIO
Molecular Weight:
344.58
Synonyms:
None
SMILES:
ClC1=CC(I)=CC=C1OCC1=CC=CC=C1
Tpsa:
9.23
Logp:
4.5236
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
3