AG001IV1

144072-30-0 | Carbamic acid, N-(4-formylphenyl)-, 1,1-dimethylethyl ester

AG001IV1

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CAS Number	144072-30-0
Catalog Number	AG001IV1(AGN-PC-0KKUEB)
Chemical Name	Carbamic acid, N-(4-formylphenyl)-, 1,1-dimethylethyl ester
IUPAC Name	tert-butyl N-(4-formylphenyl)carbamate
InChI	InChI=1S/C12H15NO3/c1-12(2,3)16-11(15)13-10-6-4-9(8-14)5-7-10/h4-8H,1-3H3,(H,13,15)
InChI Key	SVQVBAUJEKSBEC-UHFFFAOYSA-N
MDL Number	MFCD28368998
Molecular Formula	C12H15NO3
Molecular Weight	221.2524
SMILES	C(=O)C1=CC=C(C=C1)NC(OC(C)(C)C)=O
Synonyms	144072-30-0, tert-Butyl 4-formylphenylcarbamate, 4-(BOC-AMINO)BENZALDEHYDE, TERT-BUTYL (4-FORMYLPHENYL)CARBAMATE, (4-FORMYL-PHENYL)-CARBAMIC ACID TERT-BUTYL ESTER, Tert-butyl N-(4-formylphenyl)carbamate, (4-FORMYL-PHENYL)-CARBAMICACIDTERT-BUTYLESTER, 4-(tert-butoxycarbonylamino)benzaldehyde, (4-FORMylphenyl)carbaMIC ACID tert-butyl ESTER, Carbamic acid, (4-formylphenyl)-, 1,1-dimethylethyl ester, tert-butyl4-formylphenylcarbamate, ACMC-20agps, AC1MCKJ9, SCHEMBL418939, CTK4C3921, DTXSID90378109, SVQVBAUJEKSBEC-UHFFFAOYSA-N, 4-(Boc-amino)benzaldehyde, 96%, KS-00000B1N, ZINC6732191, ANW-72590, CARBAMIC ACID, N-(4-FORMYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, MFCD06245541, AKOS005257487, GL-0222, MB03751, MCULE-7023554169, RP27326, TRA0018367, AC-25591, AJ-56777, AK-33285, CJ-13091, DS-12147, SC-34336, SY020348, AB0029892, ST2407705, TC-010470, 4CH-004052, BB 0263027, CS-0042029, FT-0648394, X2046, K-4620, MFCD06245541 (95+%), N-(4-formylphenyl)carbamic acid tert-butyl ester, J-501411, Carbamic acid,N-(4-formylphenyl)-, 1,1-dimethylethyl ester, C12H15NO3, -CARBAMICACIDTERT-BUTYLESTER, CID2771821,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.105g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.256g/mol
Monoisotopic Mass	221.105g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H335
Packing Group
Precautionary statements	P261
UN Code

Certificate of Analysis

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