Basic information
- CAS
187283-17-6- Standard SMILES
CC(C)(C)OC(=O)NCc1ccc(CBr)cc1- InChIKey
UYGBIHFTZHBDEQ-UHFFFAOYSA-N- Molecular formula
- C13H18BrNO2
- Average molar mass
- 300.19 g/mol
- Monoisotopic mass
- 299.05209
Names & identifiers
- Preferred name
- tert-Butyl 4-(bromomethyl)benzylcarbamate
- IUPAC
- tert-butyl N-[[4-(bromomethyl)phenyl]methyl]carbamate
- English name
- tert-Butyl 4-(bromomethyl)benzylcarbamate
- Molecular formula
- C13H18BrNO2
- Molecular weight
- 300.19
Names & synonyms
tert-Butyl 4-(bromomethyl)benzylcarbamateRefChem:893829846-713-8187283-17-6MFCD11974929tert-butyl N-[[4-(bromomethyl)phenyl]methyl]carbamate4-(Boc-aminomethyl)benzyl Bromidetert-butyl4-(bromomethyl)benzylcarbamatetert-butyl N-{[4-(bromomethyl)phenyl]methyl}carbamatetert-butyl (4-(bromomethyl)benzyl)carbamate4-(Boc-aminomethyl)benzylBromide(4-bromomethyl-benzyl)-carbamic acid tert-butyl ester
Show more names
4-(BroMoMethyl)benzylcarbaMateN-BOC-4-(BROMOMETHYL)BENZYLAMINEbenzyl 4-(bromomethyl)benzylcarbamate4-(tert-Butoxycarbonylaminomethyl)benzyl bromideCarbamic acid, N-[[4-(bromomethyl)phenyl]methyl]-, 1,1-dimethylethyl ester
t-butyl N-[4-(bromomethyl)benzyl]carbamate(4-brSCHEMBL852071orb3175645DTXSID80634241UYGBIHFTZHBDEQ-UHFFFAOYSA-NN-boc-4-(bromomethyl)-benzylamineAKOS015836223
Database identifiers
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 242
Physicochemical properties
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Appearance
- White to light yellow Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- HS Code
- 2921490090 · 2921490090
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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.
Safety data
- hs_code
- 2921490090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers76 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
Henan Rane Chemical Co., Ltd.+86-18738066252 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Related reactions
2 records
Compound notes
Loading…