Tert-butyl (6-bromopyridin-2-YL)carbamate

HCID 13040380CAS 344331-90-4
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)OC(=O)Nc1cccc(Br)n1
InChIKey
WZDMEUOIVUZTPB-UHFFFAOYSA-N
Molecular formula
C10H13BrN2O2
Average molar mass
273.13 g/mol
Monoisotopic mass
272.01603976

Names & identifiers

Preferred name
Tert-butyl (6-bromopyridin-2-YL)carbamate
IUPAC
tert-butyl N-(6-bromo-2-pyridinyl)carbamate
English name
(6-Bromo-2-pyridinyl)-carbamic acid,1,1-dimethylethyl ester
Molecular formula
C10H13BrN2O2
Molecular weight
273.13

Names & synonyms

344331-90-4N-Boc-2-Amino-6-bromopyridine2-(BOC-AMINO)-6-BROMOPYRIDINETERT-BUTYL (6-BROMOPYRIDIN-2-YL)CARBAMATETERT-BUTYL N-(6-BROMOPYRIDIN-2-YL)CARBAMATE(6-Bromo-2-pyridinyl)-carbamic acid,1,1-dimethylethyl estertert-Butyl 6-Bromopyridin-2-ylcarbamateMFCD07367929(6-BROMO-PYRIDIN-2-YL)-CARBAMIC ACID TERT-BUTYL ESTER6-Bromo-2-tert-butoxycarbonylamino-pyridinetert-butyl N-(6-bromo-2-pyridyl)carbamateCarbamic acid, (6-bromo-2-pyridinyl)-, 1,1-dimethylethyl ester
Show more names
Cholest-5-en-3-ol,(7α)-6-BROMO-2-(N-BOC AMINO) PYRIDNEt-butyl N-(6-bromo-2-pyridinyl)carbamateBenzenemethanesulfonylchloride,9-(trifluoromethyl)-
SCHEMBL1192089SCHEMBL29497169DTXSID10516041WZDMEUOIVUZTPB-UHFFFAOYSA-NSBB051859AKOS000279063tert-Butyl 6-Bromopyridin-2-ylcarbamaAB31429

Database identifiers

CAS
344331-90-4
PubChem CID
13040380
DTXSID
DTXSID10516041
Nikkaji
J2.074.641F

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
51.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
15

Physicochemical properties

Boiling point
299.3 · 299.3±25.0 °C(Predicted)
Density
1.453 · 1.453±0.06 g/cm3(Predicted)
storage temp.
2 · under inert gas (nitrogen or Argon) at 2–8 °C
pka
11.89 · 11.89±0.70(Predicted)
Appearance
White to off-white Solid
Symbol(GHS)
7 · GHS07

Safety & regulation

Safety data

hs_code
2933399990
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers50 total

上海康恩博医药科技有限公司17510465506 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

Related reactions

35 records
New reaction record

Linked notes

Loading…