CS-0883351
2-Cyano-5-(hydroxymethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1187238-33-0
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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
C₉H₇NO₃
Molecular Weight
177.16
Synonyms
None
SMILES
O=C(O)C1=CC(CO)=CC=C1C#N
Tpsa
81.32
Logp
0.74878
H Acceptors
3
H Donors
2
Rotatable Bonds
2
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: C₉H₇NO₃
Molecular Weight: 177.16
Synonyms: None
SMILES: O=C(O)C1=CC(CO)=CC=C1C#N
Tpsa: 81.32
Logp: 0.74878
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:
C₉H₇NO₃
Molecular Weight:
177.16
Synonyms:
None
SMILES:
O=C(O)C1=CC(CO)=CC=C1C#N
Tpsa:
81.32
Logp:
0.74878
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: C₈H₃F₂NO₂
Molecular Weight: 183.11
Synonyms: None
SMILES: O=C(O)C1=C(C#N)C=CC(F)=C1F
Tpsa: 61.09
Logp: 1.53468
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:
C₈H₃F₂NO₂
Molecular Weight:
183.11
Synonyms:
None
SMILES:
O=C(O)C1=C(C#N)C=CC(F)=C1F
Tpsa:
61.09
Logp:
1.53468
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: C₇H₃FN₂O₂
Molecular Weight: 166.11
Synonyms: None
SMILES: O=C(C1=NC(F)=CC=C1C#N)O
Tpsa: 73.98
Logp: 0.79058
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:
C₇H₃FN₂O₂
Molecular Weight:
166.11
Synonyms:
None
SMILES:
O=C(C1=NC(F)=CC=C1C#N)O
Tpsa:
73.98
Logp:
0.79058
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: C₁₀H₉Cl₂NS
Molecular Weight: 246.16
Synonyms: None
SMILES: CC1(C)SC2=C(Cl)C=CC=C2C(Cl)=N1
Tpsa: 12.36
Logp: 4.1672
H Acceptors: 2
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:
C₁₀H₉Cl₂NS
Molecular Weight:
246.16
Synonyms:
None
SMILES:
CC1(C)SC2=C(Cl)C=CC=C2C(Cl)=N1
Tpsa:
12.36
Logp:
4.1672
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0