AG003SFC

78839-75-5 | tert-Butyl N-(2-bromophenyl)carbamate

AG003SFC

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CAS Number	78839-75-5
Catalog Number	AG003SFC(AGN-PC-0KWNX7)
Chemical Name	tert-Butyl N-(2-bromophenyl)carbamate
IUPAC Name	tert-butyl N-(2-bromophenyl)carbamate
InChI	InChI=1S/C11H14BrNO2/c1-11(2,3)15-10(14)13-9-7-5-4-6-8(9)12/h4-7H,1-3H3,(H,13,14)
InChI Key	UQBGKDLSIIHUEZ-UHFFFAOYSA-N
MDL Number	MFCD01006614
Molecular Formula	C11H14BrNO2
Molecular Weight	272.1384
SMILES	O=C(OC(C)(C)C)NC1=CC=CC=C1Br
Synonyms	78839-75-5, N-(tert-Butoxycarbonyl)-2-bromoaniline, tert-Butyl (2-bromophenyl)carbamate, n-boc-2-bromoaniline, tert-butyl N-(2-bromophenyl)carbamate, UQBGKDLSIIHUEZ-UHFFFAOYSA-N, ACMC-20aka7, SCHEMBL632629, (2-Bromophenyl)carbamic acid, 1,1-dimethylethyl ester, AC1MT810, CTK8C5536, tert-butyl 2-bromophenylcarbamate, DTXSID10393753, ZINC403492, KS-000009ZY, MFCD01006614, AKOS013602727, 2-Bromo-N-(tert-butoxycarbonyl)aniline, AM87207, GS-6163, 2-Bromo-N-(tert-butoxycarbonyl) aniline, AJ-22131, AK129187, AN-36586, SY041342, 2-bromo-N-(tert-Butoxy carbonyl) aniline, TC-165958, MFCD01006614 (97%), N-(tert-Butoxycarbonyl)-2-bromoaniline, 97%, tert-Butyl(2-bromophenyl)carbamate, CID3571360,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.021g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	272.142g/mol
Monoisotopic Mass	271.021g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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