Basic information
- CAS
6240-10-4- Standard SMILES
NC12CC3CC(C1)CC(C(=O)O)(C3)C2- InChIKey
ZBPOKYGSYKBAAW-UHFFFAOYSA-N- Molecular formula
- C11H17NO2
- Average molar mass
- 195.26 g/mol
Names & identifiers
- Preferred name
- 3-Aminoadamantane-1-carboxylic acid
- IUPAC
- 3-aminoadamantane-1-carboxylic acid
- English name
- 3-Amino-1-adamantanecarboxylic acid
- Molecular formula
- C11H17NO2
- Molecular weight
- 195.26
Names & synonyms
3-aminoadamantane-1-carboxylic acidRefChem:497693835-756-86240-10-43-Amino-1-adamantanecarboxylic acid3-Amino-adamantane-1-carboxylic acidTricyclo[3.3.1.13,7]decane-1-carboxylic acid, 3-amino-MFCD018378223-aminoadamantanecarboxylic acidNSC632545F0035-02503-aminoadamantanecarboxylic
Show more names
ZBPOKYGSYKBAAW-YDRMRZIKSA-N(1r,3s,5R,7S)-3-aminoadamantane-1-carboxylic acid3-aminoadamantane-1-carboxylic acid(SALTDATA: HCl)
Oprea1_390118Oprea1_787229IFLab1_000083IFLab2_000041SCHEMBL1694078CHEMBL2007921ZBPOKYGSYKBAAW-UHFFFAOYSA-N3-aminoadamantane-1-carboxylicacid
Database identifiers
- CAS
6240-10-4- PubChem CID
- 365221
- ChEMBL
CHEMBL2007921- EC Number
- 835-756-8
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Melting point
- 365 · 365-367 °C
- Boiling point
- 334.8 · 334.8±25.0 °C(Predicted)
- Density
- 1.312 · 1.312±0.06 g/cm3(Predicted)
- pka
- 4.53 · 4.53±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HazardClass
- IRRITANT
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers14 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]
上海马氏化学科技有限公司19916721580 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
JACS-郑州杰克斯化工产品有限公司0371-0371-86259281 15981966935 · [email protected]
Xuzhou B&C Chemical Technology Co., Ltd+86-400-0516-021 +86-15190678838 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
杭州肽佳生物科技有限公司0571-87213919 15967184799 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
徐州博康化学科技股份有限公司051686297676 · [email protected]
武汉鑫晟阳生物科技有限公司18402740988 18402740988 · [email protected]
Henan Lavoisier Chemical Products Co.Ltd
Related reactions
3 records
Compound notes
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