CS-1059061
2-(5-(Tert-butyl)-2-methylphenyl)acetonitrile
Manufacturer: ChemScene
CAS Number: 858004-36-1
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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#CCC1=CC(=CC=C1C)C(C)(C)C
Tpsa
23.79
Logp
3.3586
H Acceptors
1
H Donors
0
Rotatable Bonds
1
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#CCC1=CC(=CC=C1C)C(C)(C)C
Tpsa: 23.79
Logp: 3.3586
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:
C₁₃H₁₇N
Molecular Weight:
187.28
Synonyms:
None
SMILES:
N#CCC1=CC(=CC=C1C)C(C)(C)C
Tpsa:
23.79
Logp:
3.3586
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: C₆H₆N₄S
Molecular Weight: 166.20
Synonyms: None
SMILES: N1=CC(N)=CC=2N=C(SC12)N
Tpsa: 77.82
Logp: 0.8557
H Acceptors: 5
H Donors: 2
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:
C₆H₆N₄S
Molecular Weight:
166.20
Synonyms:
None
SMILES:
N1=CC(N)=CC=2N=C(SC12)N
Tpsa:
77.82
Logp:
0.8557
H Acceptors:
5
H Donors:
2
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: C₆H₆N₄OS₂
Molecular Weight: 214.27
Synonyms: None
SMILES: O=C1NC(=S)NC=2N=C(SC12)NC
Tpsa: 73.57
Logp: 1.08389
H Acceptors: 5
H Donors: 3
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:
C₆H₆N₄OS₂
Molecular Weight:
214.27
Synonyms:
None
SMILES:
O=C1NC(=S)NC=2N=C(SC12)NC
Tpsa:
73.57
Logp:
1.08389
H Acceptors:
5
H Donors:
3
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: C₅H₄N₄S
Molecular Weight: 152.18
Synonyms: None
SMILES: N=1C=NC=2N=C(SC2C1)N
Tpsa: 64.69
Logp: 0.6685
H Acceptors: 5
H Donors: 1
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:
C₅H₄N₄S
Molecular Weight:
152.18
Synonyms:
None
SMILES:
N=1C=NC=2N=C(SC2C1)N
Tpsa:
64.69
Logp:
0.6685
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
0