CS-0592778
4-Chloro-N-(prop-2-yn-1-yl)picolinamide
Manufacturer: ChemScene
CAS Number: 1091001-86-3
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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
C₉H₇ClN₂O
Molecular Weight
194.62
Synonyms
None
SMILES
O=C(C1=NC=CC(Cl)=C1)NCC#C
Tpsa
41.99
Logp
1.098
H Acceptors
2
H Donors
1
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: C₉H₇ClN₂O
Molecular Weight: 194.62
Synonyms: None
SMILES: O=C(C1=NC=CC(Cl)=C1)NCC#C
Tpsa: 41.99
Logp: 1.098
H Acceptors: 2
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:
C₉H₇ClN₂O
Molecular Weight:
194.62
Synonyms:
None
SMILES:
O=C(C1=NC=CC(Cl)=C1)NCC#C
Tpsa:
41.99
Logp:
1.098
H Acceptors:
2
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: C₁₁H₁₇Cl₂N₅O₈
Molecular Weight: 418.19
Synonyms: None
SMILES: CC1=[N+](C=C(C(=N1)N)CN2C=C[N+](=C2)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
Tpsa: 236.08
Logp: -10.041
H Acceptors: 11
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:
C₁₁H₁₇Cl₂N₅O₈
Molecular Weight:
418.19
Synonyms:
None
SMILES:
CC1=[N+](C=C(C(=N1)N)CN2C=C[N+](=C2)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
Tpsa:
236.08
Logp:
-10.041
H Acceptors:
11
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: C₁₀H₁₅IN₄
Molecular Weight: 318.16
Synonyms: None
SMILES: C1CN(C(=N1)NN)CC2=CC=CC=C2.I
Tpsa: 53.65
Logp: 0.9395
H Acceptors: 4
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:
C₁₀H₁₅IN₄
Molecular Weight:
318.16
Synonyms:
None
SMILES:
C1CN(C(=N1)NN)CC2=CC=CC=C2.I
Tpsa:
53.65
Logp:
0.9395
H Acceptors:
4
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: C₃₄H₂₇ClN₂O₄
Molecular Weight: 563.04
Synonyms: None
SMILES: C1=CC=C(C=C1)C[N+]2=C(N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O
Tpsa: 101.05
Logp: 3.0581
H Acceptors: 5
H Donors: 0
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:
C₃₄H₂₇ClN₂O₄
Molecular Weight:
563.04
Synonyms:
None
SMILES:
C1=CC=C(C=C1)C[N+]2=C(N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6.[O-]Cl(=O)(=O)=O
Tpsa:
101.05
Logp:
3.0581
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
6