CS-0582964
4-(((3-Hydroxy-3-methylbutyl)amino)methyl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1513076-99-7
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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
C₁₃H₁₈N₂O
Molecular Weight
218.29
Synonyms
None
SMILES
N#CC1=CC=C(CNCCC(C)(O)C)C=C1
Tpsa
56.05
Logp
1.80888
H Acceptors
3
H Donors
2
Rotatable Bonds
5
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1513076-99-7 | 4-[[(3-hydroxy-3-methylbutyl)amino]methyl]benzonitrile | A2B Chem | -- |
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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: C₁₃H₁₈N₂O
Molecular Weight: 218.29
Synonyms: None
SMILES: N#CC1=CC=C(CNCCC(C)(O)C)C=C1
Tpsa: 56.05
Logp: 1.80888
H Acceptors: 3
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:
C₁₃H₁₈N₂O
Molecular Weight:
218.29
Synonyms:
None
SMILES:
N#CC1=CC=C(CNCCC(C)(O)C)C=C1
Tpsa:
56.05
Logp:
1.80888
H Acceptors:
3
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: C₈H₈O₃S
Molecular Weight: 184.21
Synonyms: None
SMILES: O=C(C1=CC(OCC=C)=CS1)O
Tpsa: 46.53
Logp: 2.0111
H Acceptors: 3
H Donors: 1
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:
C₈H₈O₃S
Molecular Weight:
184.21
Synonyms:
None
SMILES:
O=C(C1=CC(OCC=C)=CS1)O
Tpsa:
46.53
Logp:
2.0111
H Acceptors:
3
H Donors:
1
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: C₁₀H₁₆O
Molecular Weight: 152.23
Synonyms: None
SMILES: C1CCC(=O)C(C1)CC2CC2
Tpsa: 17.07
Logp: 2.5458
H Acceptors: 1
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:
C₁₀H₁₆O
Molecular Weight:
152.23
Synonyms:
None
SMILES:
C1CCC(=O)C(C1)CC2CC2
Tpsa:
17.07
Logp:
2.5458
H Acceptors:
1
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: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: 2,4-dihydroxyphenyl isobutyl ketone
SMILES: CC(C)CC(=O)C1=C(C=C(C=C1)O)O
Tpsa: 57.53
Logp: 2.3266
H Acceptors: 3
H Donors: 2
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:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
2,4-dihydroxyphenyl isobutyl ketone
SMILES:
CC(C)CC(=O)C1=C(C=C(C=C1)O)O
Tpsa:
57.53
Logp:
2.3266
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
3