CS-0729148
2-(2-Phenyl-1,2-dihydroisoquinolin-1-yl)acetonitrile
Manufacturer: ChemScene
CAS Number: 904912-70-5
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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
C₁₇H₁₄N₂
Molecular Weight
246.31
Synonyms
None
SMILES
N#CCC1N(C=CC2=CC=CC=C12)C1=CC=CC=C1
Tpsa
27.03
Logp
4.13228
H Acceptors
2
H Donors
0
Rotatable Bonds
2
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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: C₁₇H₁₄N₂
Molecular Weight: 246.31
Synonyms: None
SMILES: N#CCC1N(C=CC2=CC=CC=C12)C1=CC=CC=C1
Tpsa: 27.03
Logp: 4.13228
H Acceptors: 2
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:
C₁₇H₁₄N₂
Molecular Weight:
246.31
Synonyms:
None
SMILES:
N#CCC1N(C=CC2=CC=CC=C12)C1=CC=CC=C1
Tpsa:
27.03
Logp:
4.13228
H Acceptors:
2
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: C₁₁H₁₃ClF₃N
Molecular Weight: 251.68
Synonyms: None
SMILES: Cl.N[C@@H](C1CC1)C1=CC=C(C=C1)C(F)(F)F
Tpsa: 26.02
Logp: 3.537
H Acceptors: 1
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:
C₁₁H₁₃ClF₃N
Molecular Weight:
251.68
Synonyms:
None
SMILES:
Cl.N[C@@H](C1CC1)C1=CC=C(C=C1)C(F)(F)F
Tpsa:
26.02
Logp:
3.537
H Acceptors:
1
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: C₁₇H₂₂O₅S
Molecular Weight: 338.42
Synonyms: None
SMILES: OC(=O)[C@H](CC1CCOCC1)C1=CC=C(C=C1)S(=O)(=O)C1CC1
Tpsa: 80.67
Logp: 2.6076
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₂O₅S
Molecular Weight:
338.42
Synonyms:
None
SMILES:
OC(=O)[C@H](CC1CCOCC1)C1=CC=C(C=C1)S(=O)(=O)C1CC1
Tpsa:
80.67
Logp:
2.6076
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₉N₃O
Molecular Weight: 163.18
Synonyms: None
SMILES: O=CC1=CC=NC(NC2CC2)=N1
Tpsa: 54.88
Logp: 0.8634
H Acceptors: 4
H Donors: 1
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:
C₈H₉N₃O
Molecular Weight:
163.18
Synonyms:
None
SMILES:
O=CC1=CC=NC(NC2CC2)=N1
Tpsa:
54.88
Logp:
0.8634
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
3