CS-0914287
2-(nicotinamido)ethyl nicotinate dihydrochloride
Manufacturer: ChemScene
CAS Number: 296276-16-9
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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
C₁₅H₁₄N₂O₃
Molecular Weight
270.28
Synonyms
None
SMILES
O=C(OCCNC(=O)C=1C=NC=CC1)C=2C=CC=CC2
Tpsa
68.29
Logp
1.6684
H Acceptors
4
H Donors
1
Rotatable Bonds
5
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: C₁₅H₁₄N₂O₃
Molecular Weight: 270.28
Synonyms: None
SMILES: O=C(OCCNC(=O)C=1C=NC=CC1)C=2C=CC=CC2
Tpsa: 68.29
Logp: 1.6684
H Acceptors: 4
H Donors: 1
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:
C₁₅H₁₄N₂O₃
Molecular Weight:
270.28
Synonyms:
None
SMILES:
O=C(OCCNC(=O)C=1C=NC=CC1)C=2C=CC=CC2
Tpsa:
68.29
Logp:
1.6684
H Acceptors:
4
H Donors:
1
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: C₁₇H₂₂N₂O₂
Molecular Weight: 286.37
Synonyms: None
SMILES: O(C)[C@]12C=3C=4C(C[C@]1(N(C)C[C@H](CO)C2)[H])=CNC4C=CC3
Tpsa: 48.49
Logp: 1.8783
H Acceptors: 3
H Donors: 2
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:
C₁₇H₂₂N₂O₂
Molecular Weight:
286.37
Synonyms:
None
SMILES:
O(C)[C@]12C=3C=4C(C[C@]1(N(C)C[C@H](CO)C2)[H])=CNC4C=CC3
Tpsa:
48.49
Logp:
1.8783
H Acceptors:
3
H Donors:
2
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: C₁₇H₂₂N₂O
Molecular Weight: 270.37
Synonyms: None
SMILES: CN1C2=C3C([C@@]4([C@@](CC3=C1)(N(C)C[C@H](CO)C4)[H])[H])=CC=C2
Tpsa: 28.4
Logp: 2.1306
H Acceptors: 3
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:
C₁₇H₂₂N₂O
Molecular Weight:
270.37
Synonyms:
None
SMILES:
CN1C2=C3C([C@@]4([C@@](CC3=C1)(N(C)C[C@H](CO)C4)[H])[H])=CC=C2
Tpsa:
28.4
Logp:
2.1306
H Acceptors:
3
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: C₇H₈N₂O₅S
Molecular Weight: 232.21
Synonyms: None
SMILES: O=N(=O)C1=CC=C(NS(=O)(=O)C)C(O)=C1
Tpsa: 109.54
Logp: 0.6719
H Acceptors: 5
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:
C₇H₈N₂O₅S
Molecular Weight:
232.21
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C(NS(=O)(=O)C)C(O)=C1
Tpsa:
109.54
Logp:
0.6719
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
3