CS-0596117
4-Methyl-4-nitro-1-(thiophen-2-yl)pentan-1-one
Manufacturer: ChemScene
CAS Number: 400085-20-3
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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
C₁₀H₁₃NO₃S
Molecular Weight
227.28
Synonyms
None
SMILES
CC(C)(CCC(=O)C1=CC=CS1)[N+](=O)[O-]
Tpsa
60.21
Logp
2.7663
H Acceptors
4
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: C₁₀H₁₃NO₃S
Molecular Weight: 227.28
Synonyms: None
SMILES: CC(C)(CCC(=O)C1=CC=CS1)[N+](=O)[O-]
Tpsa: 60.21
Logp: 2.7663
H Acceptors: 4
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:
C₁₀H₁₃NO₃S
Molecular Weight:
227.28
Synonyms:
None
SMILES:
CC(C)(CCC(=O)C1=CC=CS1)[N+](=O)[O-]
Tpsa:
60.21
Logp:
2.7663
H Acceptors:
4
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: C₁₂H₁₃BrN₂O
Molecular Weight: 281.15
Synonyms: None
SMILES: C1CNCC1N2CC3=C(C2=O)C=C(C=C3)Br
Tpsa: 32.34
Logp: 1.7668
H Acceptors: 2
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:
C₁₂H₁₃BrN₂O
Molecular Weight:
281.15
Synonyms:
None
SMILES:
C1CNCC1N2CC3=C(C2=O)C=C(C=C3)Br
Tpsa:
32.34
Logp:
1.7668
H Acceptors:
2
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: C₁₀H₁₂N₂O₂
Molecular Weight: 192.21
Synonyms: None
SMILES: CC1(C2=CC(=C(C=C2NC1=O)N)O)C
Tpsa: 75.35
Logp: 1.2041
H Acceptors: 3
H Donors: 3
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:
C₁₀H₁₂N₂O₂
Molecular Weight:
192.21
Synonyms:
None
SMILES:
CC1(C2=CC(=C(C=C2NC1=O)N)O)C
Tpsa:
75.35
Logp:
1.2041
H Acceptors:
3
H Donors:
3
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: C₁₃H₁₆O₄
Molecular Weight: 236.26
Synonyms: None
SMILES: CCOC1=CC=C(C=C1)C(=O)CC2OCCO2
Tpsa: 44.76
Logp: 2.031
H Acceptors: 4
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:
C₁₃H₁₆O₄
Molecular Weight:
236.26
Synonyms:
None
SMILES:
CCOC1=CC=C(C=C1)C(=O)CC2OCCO2
Tpsa:
44.76
Logp:
2.031
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
5