Benzyl Carbamate

CAT: 1299-RG-B010800-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-B010800-01Size:10 mg

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CAS Number

621-84-1

Synonyms

Carbamic Acid Benzyl Ester

Molecular Formula

C8H9NO2

Molecular Weight

151.17

Product Name Synonym

Carbamic Acid Benzyl Ester

Chemical Information

Benzyl carbamate

CAS Number	621-84-1
PubChem CID	12136
IUPAC Name	benzyl carbamate
Molecular Formula	C8H9NO2
Molecular Weight	151.16
XLogP	1.2
Topological Polar Surface Area	52.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	11
Formal Charge	0
Complexity	130

SMILES

C1=CC=C(C=C1)COC(=O)N

InChI

InChI=1S/C8H9NO2/c9-8(10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)

InChIKey

PUJDIJCNWFYVJX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 621-84-1

CID: 12136

Formula: C8H9NO2

MW: 151.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	151.16
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	151.063328530
Monoisotopic Mass	151.063328530
Topological Polar Surface Area	52.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	130
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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RG-T051845-01	Tert-Butyl (2- (Benzyl (Methyl) Amino) Ethyl) Carbamate
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RG-B051465-01	Benzyl Hydrogen Carbonate
RG-M052013-01	Methyl Carbamate
RG-E200812-01	Ethyl Carbamate
RG-E140123-01	Isopropyl carbamate

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