tert-Butoxycarbonylamino-naphthalen-1-yl-acetic acid
Basic information
- CAS
14675-99-1- Standard SMILES
CC(C)(C)OC(=O)NC(C(=O)O)c1cccc2ccccc12- InChIKey
HRBQDQOOFCWHTR-UHFFFAOYSA-N- Molecular formula
- C17H19NO4
- Average molar mass
- 301.34 g/mol
- Monoisotopic mass
- 301.13140809
Names & identifiers
- Preferred name
- tert-Butoxycarbonylamino-naphthalen-1-yl-acetic acid
- IUPAC
- 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-ylacetic acid
- English name
- tert-Butoxycarbonylamino-naphthalen-1-yl-acetic acid
- Molecular formula
- C17H19NO4
- Molecular weight
- 301.34
Names & synonyms
14675-99-1tert-Butoxycarbonylamino-naphthalen-1-yl-acetic acid2-((tert-Butoxycarbonyl)amino)-2-(naphthalen-1-yl)acetic acid(N-BOC-Amino)(naphthalen-1-yl)acetic acid2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-naphthalen-1-ylacetic acida-(Boc-amino)-1-naphthaleneacetic acid2-{[(tert-butoxy)carbonyl]amino}-2-(naphthalen-1-yl)acetic acidBoc-(S)-naphthyl glycinetert-butoxycarbonylamino-naphthalen-1-yl-aceticacidSCHEMBL110497421-naphthaleneacetic acid,a-[[(1,1-dimethylethoxy)carbonyl]amino]-MFCD07388849
Show more names
2-(tert-butoxycarbonylamino)-2-(naphthalen-1-yl)acetic acid1-NAPHTHALENEACETIC ACID,α-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-
AKOS026745521AB08702AB33263BS-27650DB-371738N12891EN300-1071248F797339
Database identifiers
- CAS
14675-99-1- PubChem CID
- 4122650
- EC Number
- 179-264-5
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 415
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Suppliers
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Related reactions
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Compound notes
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