AG001T16

162356-90-3 | Carbamic acid, N-[(2-bromophenyl)methyl]-, 1,1-dimethylethyl ester

AG001T16

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CAS Number	162356-90-3
Catalog Number	AG001T16(AGN-PC-0LW82Q)
Chemical Name	Carbamic acid, N-[(2-bromophenyl)methyl]-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-[(2-bromophenyl)methyl]carbamate
InChI	InChI=1S/C12H16BrNO2/c1-12(2,3)16-11(15)14-8-9-6-4-5-7-10(9)13/h4-7H,8H2,1-3H3,(H,14,15)
InChI Key	DFNZFCPEUDSNEO-UHFFFAOYSA-N
MDL Number	MFCD05664385
Molecular Formula	C12H16BrNO2
Molecular Weight	286.1649
SMILES	O=C(OC(C)(C)C)NCC1=CC=CC=C1Br
Synonyms	162356-90-3, tert-butyl 2-bromobenzylcarbamate, N-Boc-2-bromobenzylamine, N-(tert-Butoxycarbonyl)-2-bromobenzylamine, tert-butyl N-[(2-bromophenyl)methyl]carbamate, (2-Bromo-benzyl)-carbamic acid tert-butyl ester, Tert-butyl (2-bromobenzyl)carbamate, MFCD05664385, (2-Bromobenzyl)carbamic Acid tert-Butyl Ester, 1-(tert-butoxycarbonylaminomethyl)-2-bromobenzene, Carbamic acid, [(2-bromophenyl)methyl]-, 1,1-dimethylethyl ester, PubChem7804, N-(Tert-butoxycarbonyl) -2-bromobenzylamine, ACMC-1BXY5, SCHEMBL1329466, CTK4D1203, tert-butyl-2-bromobenzylcarbamate, DTXSID40426987, N-Boc-2-bromobenzylamine, 97%, DFNZFCPEUDSNEO-UHFFFAOYSA-N, tert-butyl 2-bromoberizylcarbamate, tert-butyl(2-bromobenzyl)carbamate, KS-00000B8J, ZINC2548341, t-Butyl N-(2-bromobenzyl)carbamate, ANW-21991, AR2300, AKOS013101208, CB-1924, CS-W003244, QC-1759, VZ33748, N-tert-butoxycarbonyl-2-bromobenzylamine, TRA-0205638, N-(t-Butoxycarbonyl)-2-bromobenzylamine, AC-27711, AJ-39520, AN-31196, AS-45319, CJ-09326, SC-53835, SY018574, 2-Bromo-N-(tert-butoxycarbonyl)benzylamine, AB0063613, DB-050620, RT-014305, 2-bromobenzyl-carbamic acid tert-butyl ester, FT-0652738, ST24049668, V3628, K-5074, MFCD05664385 (97+%), 356B903, I01-5813, J-009927, Carbamic acid, N-[(2-bromophenyl)methyl]-, 1,1-dimethylethyl ester, Carbamic acid,N-[(2-bromophenyl)methyl]-, 1,1-dimethylethyl ester, C12H16BrNO2, ZINC02548341, ACN-052134, CID7018300, B4920, 2-(tert-Butoxycarbonylaminomethyl)bromobenzene,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	285.036g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	286.169g/mol
Monoisotopic Mass	285.036g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	38.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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