CS-1016430
3-Chloro-5-(2-oxopropyl)benzonitrile
Manufacturer: ChemScene
CAS Number: 1806591-18-3
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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
C₁₀H₈ClNO
Molecular Weight
193.63
Synonyms
None
SMILES
N#CC1=CC(CC(C)=O)=CC(Cl)=C1
Tpsa
40.86
Logp
2.34318
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: C₁₀H₈ClNO
Molecular Weight: 193.63
Synonyms: None
SMILES: N#CC1=CC(CC(C)=O)=CC(Cl)=C1
Tpsa: 40.86
Logp: 2.34318
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:
C₁₀H₈ClNO
Molecular Weight:
193.63
Synonyms:
None
SMILES:
N#CC1=CC(CC(C)=O)=CC(Cl)=C1
Tpsa:
40.86
Logp:
2.34318
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₈ClFO
Molecular Weight: 174.60
Synonyms: None
SMILES: FC1=CC=C(OCCl)C(=C1)C
Tpsa: 9.23
Logp: 2.70922
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₈ClFO
Molecular Weight:
174.60
Synonyms:
None
SMILES:
FC1=CC=C(OCCl)C(=C1)C
Tpsa:
9.23
Logp:
2.70922
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₉ClO₃
Molecular Weight: 212.63
Synonyms: None
SMILES: O=C(O)CC1OC2=CC(Cl)=CC=C2C1
Tpsa: 46.53
Logp: 2.1182
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₉ClO₃
Molecular Weight:
212.63
Synonyms:
None
SMILES:
O=C(O)CC1OC2=CC(Cl)=CC=C2C1
Tpsa:
46.53
Logp:
2.1182
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂O₂S
Molecular Weight: 196.27
Synonyms: None
SMILES: O=CC=1SC(=CC1)C2CCOCC2
Tpsa: 26.3
Logp: 2.4546
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂O₂S
Molecular Weight:
196.27
Synonyms:
None
SMILES:
O=CC=1SC(=CC1)C2CCOCC2
Tpsa:
26.3
Logp:
2.4546
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2