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Cas Database |
| Name |
cis-4-Aminocyclohexanecarboxylic acid |
EINECS | 626-259-5 |
| CAS No. | 3685-23-2 | Density | 1.134 g/cm3 |
| PSA | 63.32000 | LogP | 1.28880 |
| Solubility | Soluble in water | Melting Point |
299-301 °C(lit.) |
| Formula | C7H13NO2 | Boiling Point | 279.993 °C at 760 mmHg |
| Molecular Weight | 143.186 | Flash Point | 123.136 °C |
| Transport Information | N/A | Appearance | off-white powder |
| Safety | 26-36 | Risk Codes | 36/37/38 |
| Molecular Structure |
|
Hazard Symbols |
 Xi
|
| Synonyms |
(cis-4-Carboxycyclohexyl)amine;1,4-cis-Aminocyclohexanecarboxylic acid;UK 22314;cis-4-Aminocyclohexane-1-carboxylic acid; |
Article Data | 18 |
cis-4-Aminocyclohexanecarboxylic acid Chemical Properties
Molecular Structure of cis-4-Aminocyclohexanecarboxylic acid (CAS No.3685-23-2):
Molecular Formula: C7H13NO2
Molecular Weight: 143.18
CAS No: 3685-23-2
Melting point: 299-301 ºC
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 0
Topological Polar Surface Area: 67.8
Heavy Atom Count: 10
Formal Charge: 0
Complexity: 122
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Appearence: Off-white powder
IUPAC Name: 4-Azaniumylcyclohexane-1-carboxylate
Canonical SMILES: C1CC(CCC1C(=O)[O-])[NH3+]
InChI: InChI=1S/C7H13NO2/c8-6-3-1-5(2-4-6)7(9)10/h5-6H,1-4,8H2,(H,9,10)
InChIKey: DRNGLYHKYPNTEA-UHFFFAOYSA-N
Product Categories: 4-Substituted Cyclohexanecarboxylic Acids;C7;Carbonyl Compounds;Carboxylic Acids;Alicyclic Amino Acids;Peptide Synthesis;Unnatural Amino Acid Derivatives
cis-4-Aminocyclohexanecarboxylic acid Safety Profile
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant
cis-4-Aminocyclohexanecarboxylic acid Specification
cis-4-Aminocyclohexanecarboxylic acid (CAS No.3685-23-2), it also can be called cis-4-Amino-1-cyclohexanecarboxylic acid .
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