CS-1001311
1,3-Diethyl 2-[2-(2-benzoyl-1H-pyrrol-1-yl)ethyl]propanedioate
Manufacturer: ChemScene
CAS Number: 141031-78-9
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Purity
95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₀H₂₃NO₅
Molecular Weight
357.40
Synonyms
None
SMILES
O=C(OCC)C(C(=O)OCC)CCN1C=CC=C1C(=O)C=2C=CC=CC2
Tpsa
74.6
Logp
2.8516
H Acceptors
6
H Donors
0
Rotatable Bonds
9
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₀H₂₃NO₅
Molecular Weight: 357.40
Synonyms: None
SMILES: O=C(OCC)C(C(=O)OCC)CCN1C=CC=C1C(=O)C=2C=CC=CC2
Tpsa: 74.6
Logp: 2.8516
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 9
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₀H₂₃NO₅
Molecular Weight:
357.40
Synonyms:
None
SMILES:
O=C(OCC)C(C(=O)OCC)CCN1C=CC=C1C(=O)C=2C=CC=CC2
Tpsa:
74.6
Logp:
2.8516
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
9
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₁NO₃
Molecular Weight: 229.23
Synonyms: None
SMILES: O=C(O)CC1=CC=C(N1)C(=O)C=2C=CC=CC2
Tpsa: 70.16
Logp: 1.8728
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₁NO₃
Molecular Weight:
229.23
Synonyms:
None
SMILES:
O=C(O)CC1=CC=C(N1)C(=O)C=2C=CC=CC2
Tpsa:
70.16
Logp:
1.8728
H Acceptors:
2
H Donors:
2
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: C₁₃H₁₁NO₃
Molecular Weight: 229.23
Synonyms: None
SMILES: O=C(O)CC1=CC(=CN1)C(=O)C=2C=CC=CC2
Tpsa: 70.16
Logp: 1.8728
H Acceptors: 2
H Donors: 2
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:
C₁₃H₁₁NO₃
Molecular Weight:
229.23
Synonyms:
None
SMILES:
O=C(O)CC1=CC(=CN1)C(=O)C=2C=CC=CC2
Tpsa:
70.16
Logp:
1.8728
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
4
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₀O₂
Molecular Weight: 174.20
Synonyms: None
SMILES: O=C1[C@]2([C@@](C2)(CO1)[H])C3=CC=CC=C3
Tpsa: 26.3
Logp: 1.5011
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₀O₂
Molecular Weight:
174.20
Synonyms:
None
SMILES:
O=C1[C@]2([C@@](C2)(CO1)[H])C3=CC=CC=C3
Tpsa:
26.3
Logp:
1.5011
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
1