CS-1078885
4-Hexylbenzonitrile
Manufacturer: ChemScene
CAS Number: 29147-95-3
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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
C₁₃H₁₇N
Molecular Weight
187.28
Synonyms
None
SMILES
N#CC1=CC=C(C=C1)CCCCCC
Tpsa
23.79
Logp
3.68108
H Acceptors
1
H Donors
0
Rotatable Bonds
5
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: C₁₃H₁₇N
Molecular Weight: 187.28
Synonyms: None
SMILES: N#CC1=CC=C(C=C1)CCCCCC
Tpsa: 23.79
Logp: 3.68108
H Acceptors: 1
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:
C₁₃H₁₇N
Molecular Weight:
187.28
Synonyms:
None
SMILES:
N#CC1=CC=C(C=C1)CCCCCC
Tpsa:
23.79
Logp:
3.68108
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
5
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₈N₂O₅
Molecular Weight: 260.20
Synonyms: None
SMILES: O=N(=O)C=1C=CC=C(OC=2C=CC=CC2N(=O)=O)C1
Tpsa: 95.51
Logp: 3.2953
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 4
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₈N₂O₅
Molecular Weight:
260.20
Synonyms:
None
SMILES:
O=N(=O)C=1C=CC=C(OC=2C=CC=CC2N(=O)=O)C1
Tpsa:
95.51
Logp:
3.2953
H Acceptors:
5
H Donors:
0
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: C₁₀H₈N₂O₅
Molecular Weight: 236.18
Synonyms: None
SMILES: O=C(OC1C(=O)NC2=CC=C(C=C21)N(=O)=O)C
Tpsa: 98.54
Logp: 1.1511
H Acceptors: 5
H Donors: 1
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:
C₁₀H₈N₂O₅
Molecular Weight:
236.18
Synonyms:
None
SMILES:
O=C(OC1C(=O)NC2=CC=C(C=C21)N(=O)=O)C
Tpsa:
98.54
Logp:
1.1511
H Acceptors:
5
H Donors:
1
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: C₁₅H₂₅NO₄
Molecular Weight: 283.36
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCC(C(=O)OC)(C1)CCC=C
Tpsa: 55.84
Logp: 2.7528
H Acceptors: 4
H Donors: 0
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:
C₁₅H₂₅NO₄
Molecular Weight:
283.36
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCC(C(=O)OC)(C1)CCC=C
Tpsa:
55.84
Logp:
2.7528
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4