CS-0767936
3-Ethoxy-4-(Propylamino)cyclobut-3-ene-1,2-dione
Manufacturer: ChemScene
CAS Number: 175204-29-2
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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
C₉H₁₃NO₃
Molecular Weight
183.20
Synonyms
None
SMILES
CCCNC1=C(OCC)C(=O)C1=O
Tpsa
55.4
Logp
0.5032
H Acceptors
4
H Donors
1
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: C₉H₁₃NO₃
Molecular Weight: 183.20
Synonyms: None
SMILES: CCCNC1=C(OCC)C(=O)C1=O
Tpsa: 55.4
Logp: 0.5032
H Acceptors: 4
H Donors: 1
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:
C₉H₁₃NO₃
Molecular Weight:
183.20
Synonyms:
None
SMILES:
CCCNC1=C(OCC)C(=O)C1=O
Tpsa:
55.4
Logp:
0.5032
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂O₂
Molecular Weight: 164.20
Synonyms: None
SMILES: CC(CO)C(=O)C1=CC=CC=C1
Tpsa: 37.3
Logp: 1.4977
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂O₂
Molecular Weight:
164.20
Synonyms:
None
SMILES:
CC(CO)C(=O)C1=CC=CC=C1
Tpsa:
37.3
Logp:
1.4977
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀N₂O₃
Molecular Weight: 194.19
Synonyms: None
SMILES: COC1=C(OC)C=C2C(=O)NNC2=C1
Tpsa: 67.11
Logp: 0.8734
H Acceptors: 3
H Donors: 2
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀N₂O₃
Molecular Weight:
194.19
Synonyms:
None
SMILES:
COC1=C(OC)C=C2C(=O)NNC2=C1
Tpsa:
67.11
Logp:
0.8734
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₀S
Molecular Weight: 198.28
Synonyms: None
SMILES: CC1=CC2=C(C=C1)C1=C(S2)C=CC=C1
Tpsa: 0
Logp: 4.36292
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀S
Molecular Weight:
198.28
Synonyms:
None
SMILES:
CC1=CC2=C(C=C1)C1=C(S2)C=CC=C1
Tpsa:
0
Logp:
4.36292
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0