CS-0840668
2,3,4,5-Tetrahydro-1H-benzo[d]azepine-2-carboxylic acid
Manufacturer: ChemScene
CAS Number: 188989-97-1
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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
C₁₁H₁₃NO₂
Molecular Weight
191.23
Synonyms
None
SMILES
O=C(C1NCCC2=C(C1)C=CC=C2)O
Tpsa
49.33
Logp
0.828
H Acceptors
2
H Donors
2
Rotatable Bonds
1
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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: C₁₁H₁₃NO₂
Molecular Weight: 191.23
Synonyms: None
SMILES: O=C(C1NCCC2=C(C1)C=CC=C2)O
Tpsa: 49.33
Logp: 0.828
H Acceptors: 2
H Donors: 2
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:
C₁₁H₁₃NO₂
Molecular Weight:
191.23
Synonyms:
None
SMILES:
O=C(C1NCCC2=C(C1)C=CC=C2)O
Tpsa:
49.33
Logp:
0.828
H Acceptors:
2
H Donors:
2
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: C₁₁H₉NO₂
Molecular Weight: 187.19
Synonyms: None
SMILES: O=C(C1=C(C)C=C2C=CC=NC2=C1)O
Tpsa: 50.19
Logp: 2.24142
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:
C₁₁H₉NO₂
Molecular Weight:
187.19
Synonyms:
None
SMILES:
O=C(C1=C(C)C=C2C=CC=NC2=C1)O
Tpsa:
50.19
Logp:
2.24142
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: C₇H₇F₃N₂O
Molecular Weight: 192.14
Synonyms: None
SMILES: OC(C)C1=NC=C(C(F)(F)F)N=C1
Tpsa: 46.01
Logp: 1.5487
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:
C₇H₇F₃N₂O
Molecular Weight:
192.14
Synonyms:
None
SMILES:
OC(C)C1=NC=C(C(F)(F)F)N=C1
Tpsa:
46.01
Logp:
1.5487
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: C₇H₉ClF₃N₃
Molecular Weight: 227.61
Synonyms: None
SMILES: FC(F)(C1=NC=C([C@@H](N)C)N=C1)F.Cl
Tpsa: 51.8
Logp: 1.9369
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:
C₇H₉ClF₃N₃
Molecular Weight:
227.61
Synonyms:
None
SMILES:
FC(F)(C1=NC=C([C@@H](N)C)N=C1)F.Cl
Tpsa:
51.8
Logp:
1.9369
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1