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100134-82-5,MFCD10698635
Catalog No.:AA0000ZF
100134-82-5 | Carbamic acid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester
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1mg
>95%
3 weeks  
$150.00
- +
5mg
>95%
3 weeks  
$162.00
- +
10mg
>95%
3 weeks  
$185.00
- +
500mg
>95%
3 weeks  
$209.00
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1g
>95%
3 weeks  
$249.00
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5g
>95%
3 weeks  
$526.00
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10g
>95%
3 weeks  
$911.00
- +
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Technical Information
Catalog Number:
AA0000ZF
Chemical Name:
Carbamic acid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester
CAS Number:
100134-82-5
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
MDL Number:
MFCD10698635
IUPAC Name:
benzyl N-(2-cyanopropan-2-yl)carbamate
InChI:
InChI=1S/C12H14N2O2/c1-12(2,9-13)14-11(15)16-8-10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,14,15)
InChI Key:
DJQKBMUYZUEUBU-UHFFFAOYSA-N
SMILES:
N#CC(NC(=O)OCc1ccccc1)(C)C
EC Number:
600-032-0
Properties
Computed Properties
 
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Synonyms
 
100134-82-5 
Benzyl (1-cyano-1-methylethyl)carbamate 
Carbamicacid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester 
ACMC-1BTWW 
benzylcyanomethylethylcarbamate 
AMBZ0388 
SCHEMBL1150695 
CTK3J8575 
DTXSID80593804 
DJQKBMUYZUEUBU-UHFFFAOYSA-N 
Carbamic acid, N-(1-cyano-1-methylethyl)-, phenylmethyl ester 
KS-000029RB 
BENZYL (2-CYANOPROPAN-2-YL)CARBAMATE 
0103AA 
ANW-44753 
MFCD10698635 
ZINC21297164 
Benzyl 1-cyano-1-methylethylcarbamate 
AKOS015836095 
AM85435 
AN-3539 
API0007640 
Benzyl[1-cyano-1-methylethyl]carbamate 
benzyl N-(1-cyano-1-methylethyl)carbamate 
FCH1747574 
MCULE-5736583338 
NE-0200 
PB34539 
RP12628 
RTR-000045 
benzyl N-(2-cyanopropan-2-yl)carbamate 
AJ-78090 
AK-43465 
AB1008487 
Benzyl [1-cyano-1-methylethyl]carbamate 
AX8210954 
DB-022605 
TL8000036 
TR-000045 
FT-0662720 
ST24030137 
Q-1259 
(phenylmethyl) N-(2-cyanopropan-2-yl)carbamate 
134B825 
A800053 
Benzyl 2-cyanopropan-2-ylcarbamate 
J-000052 
J-519765 
I14-26369 
N-(2-cyanopropan-2-yl)carbamic acid (phenylmethyl) ester 
null 
C12H14N2O2 
ACN-046775 
Benzyl(1-cyano-1-methylethyl)carbamate 
benzyl N-(1-cyano-1-methyl-ethyl)carbamate 
N-(1-cyano-1-methylethyl)-, phenylmethyl ester 
(cyano-dimethyl-methyl)carbamic acid benzyl ester 
Carbamic acid, (1-cyano-1-methylethyl)-, phenylmethyl ester 
Literature
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