CS-0540605
7-(Aminomethyl)-2-methyl-1,4-dihydroisoquinolin-3(2H)-one
Manufacturer: ChemScene
CAS Number: 1934829-49-8
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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
C₁₁H₁₄N₂O
Molecular Weight
190.24
Synonyms
None
SMILES
O=C1N(C)CC2=C(C=CC(CN)=C2)C1
Tpsa
46.33
Logp
0.6598
H Acceptors
2
H Donors
1
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: C₁₁H₁₄N₂O
Molecular Weight: 190.24
Synonyms: None
SMILES: O=C1N(C)CC2=C(C=CC(CN)=C2)C1
Tpsa: 46.33
Logp: 0.6598
H Acceptors: 2
H Donors: 1
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:
C₁₁H₁₄N₂O
Molecular Weight:
190.24
Synonyms:
None
SMILES:
O=C1N(C)CC2=C(C=CC(CN)=C2)C1
Tpsa:
46.33
Logp:
0.6598
H Acceptors:
2
H Donors:
1
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: C₁₂H₂₁NO₃
Molecular Weight: 227.30
Synonyms: None
SMILES: O=C(N1CC2(COCCC2)C1)OC(C)(C)C
Tpsa: 38.77
Logp: 2.0339
H Acceptors: 3
H Donors: 0
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:
C₁₂H₂₁NO₃
Molecular Weight:
227.30
Synonyms:
None
SMILES:
O=C(N1CC2(COCCC2)C1)OC(C)(C)C
Tpsa:
38.77
Logp:
2.0339
H Acceptors:
3
H Donors:
0
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: C₉H₁₅NO₂S
Molecular Weight: 201.29
Synonyms: Ethanethioic acid, S-(1-acetyl-3-piperidinyl) ester
SMILES: CC(SC1CN(C(C)=O)CCC1)=O
Tpsa: 37.38
Logp: 1.277
H Acceptors: 3
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:
C₉H₁₅NO₂S
Molecular Weight:
201.29
Synonyms:
Ethanethioic acid, S-(1-acetyl-3-piperidinyl) ester
SMILES:
CC(SC1CN(C(C)=O)CCC1)=O
Tpsa:
37.38
Logp:
1.277
H Acceptors:
3
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: C₅H₅F₃N₂O₂
Molecular Weight: 182.10
Synonyms: None
SMILES: OCCC1=NN=C(C(F)(F)F)O1
Tpsa: 59.15
Logp: 0.6232
H Acceptors: 4
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:
C₅H₅F₃N₂O₂
Molecular Weight:
182.10
Synonyms:
None
SMILES:
OCCC1=NN=C(C(F)(F)F)O1
Tpsa:
59.15
Logp:
0.6232
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2