CS-0551467
1-(3-Chloro-3-methylbut-1-yn-1-yl)-4-methoxybenzene
Manufacturer: ChemScene
CAS Number: 75111-06-7
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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
C₁₂H₁₃ClO
Molecular Weight
208.68
Synonyms
None
SMILES
ClC(C#CC1=CC=C(OC)C=C1)(C)C
Tpsa
9.23
Logp
3.0641
H Acceptors
1
H Donors
0
Rotatable Bonds
1
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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: C₁₂H₁₃ClO
Molecular Weight: 208.68
Synonyms: None
SMILES: ClC(C#CC1=CC=C(OC)C=C1)(C)C
Tpsa: 9.23
Logp: 3.0641
H Acceptors: 1
H Donors: 0
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:
C₁₂H₁₃ClO
Molecular Weight:
208.68
Synonyms:
None
SMILES:
ClC(C#CC1=CC=C(OC)C=C1)(C)C
Tpsa:
9.23
Logp:
3.0641
H Acceptors:
1
H Donors:
0
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: C₉H₉NO₃
Molecular Weight: 179.17
Synonyms: 1-(2-methylphenyl)-2-nitroethanone
SMILES: O=[N+](CC(C1=CC=CC=C1C)=O)[O-]
Tpsa: 60.21
Logp: 1.45442
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:
C₉H₉NO₃
Molecular Weight:
179.17
Synonyms:
1-(2-methylphenyl)-2-nitroethanone
SMILES:
O=[N+](CC(C1=CC=CC=C1C)=O)[O-]
Tpsa:
60.21
Logp:
1.45442
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: C₁₂H₂₄O
Molecular Weight: 184.32
Synonyms: 7-Ethyl-2-methyl-4-nonanone
SMILES: CCC(CC)CCC(=O)CC(C)C
Tpsa: 17.07
Logp: 3.818
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₄O
Molecular Weight:
184.32
Synonyms:
7-Ethyl-2-methyl-4-nonanone
SMILES:
CCC(CC)CCC(=O)CC(C)C
Tpsa:
17.07
Logp:
3.818
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₁₆N₂O₄S
Molecular Weight: 308.35
Synonyms: None
SMILES: CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=CC2=C1N=CC=C2
Tpsa: 96.36
Logp: 1.6223
H Acceptors: 4
H Donors: 2
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:
C₁₄H₁₆N₂O₄S
Molecular Weight:
308.35
Synonyms:
None
SMILES:
CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=CC2=C1N=CC=C2
Tpsa:
96.36
Logp:
1.6223
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
5