N-(2-Cyanoethyl)glycine
Properties
- Molecular formula
- C5H8N2O2
- Molar mass
- 128.13 g/mol
- Exact mass
- 128.0586 Da
- Melting point
- 190–191 °C
- logP
- -0.43Crippen estimate
- Polar surface area
- 73.1 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 4
Hazards
Danger
- H302 Harmful if swallowed71.4% of notifiers
- H312 Harmful in contact with skin85.7% of notifiers
- H315 Causes skin irritation28.6% of notifiers
- H318 Causes serious eye damage14.3% of notifiers
- H319 Causes serious eye irritation14.3% of notifiers
- H332 Harmful if inhaled71.4% of notifiers
- H335 May cause respiratory irritation14.3% of notifiers
Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
3088-42-4SMILES
N#CCCNCC(=O)OInChIKey
KZUBZCHAWPDYQX-UHFFFAOYSA-NInChI
InChI=1S/C5H8N2O2/c6-2-1-3-7-4-5(8)9/h7H,1,3-4H2,(H,8,9)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Glycine, N-(2-cyanoethyl)-
- α-(β′-Cyanoethyl)aminoacetic acid
- NSC 11804
- NSC 133475
- 2-(2-Cyanoethylamino)acetic acid
Work with N-(2-Cyanoethyl)glycine
Similar compounds
Ethylenediaminediacetic acid5657-17-062 % similar
Iminodiacetic acid142-73-454 % similar
N-(2-Aminoethyl)glycine24123-14-652 % similar
4-Cyanobutanoic acid39201-33-752 % similar
Idpn (chemical)111-94-450 % similar
Cyanoacetic acid372-09-848 % similar
N-(Phenylmethyl)glycine17136-36-646 % similar
N-Benzylglycine hydrochloride7689-50-142 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds